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Muscle FW NEG Measurements
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13.03_641.4290m/z | 641.42903277086 | 1 | 13.0260333333333 | 0.165733333333334 | 0 | 9.26692148550679E-5 | 2.19806231333081 | QCs | Blank | 100 - 16.1 | 70.951206110605 | 6.12 | 46.3899214307773 | 51.5162059068793 | 17.3811915628714 | 13.8285950211111 | 71.9387595029753 | 80.3334340727857 | 72.8050719089606 | 53.2298420707398 | 76.6870374746561 | 73.0887739917628 | 70.3286610380982 | 69.1980688248616 | 60.6131894392325 | 63.0038909833828 | 52.7899554818898 | 52.9598542926971 | 55.3357464955085 | 45.1454268156998 | 47.2045577925521 | 57.077434079459 | 54.893283956893 | 61.7104916097672 | 62.2184972418703 | 43.6934813448496 | 72.044503299326 | 62.9686485037322 | 71.7682580754733 | 68.667100195679 | 81.5442117449434 | 64.8382423924997 | 71.0741717299325 | 60.2569697393503 | 62.6915642241717 | 64.6996386905723 | 57.1810107627255 | 67.0197023645611 | 28.7259325204799 | 34.5426734216123 | 12.5338635554323 | 9.33587658404872 | 85.6438476175267 | 93.2884668926832 | 82.5359372642045 | 53.2298420707398 | 72.8316760015617 | 67.6873398285825 | 65.2738343259611 | 62.8515695792934 | 63.8664111591776 | 65.2520380536046 | 59.5996228504818 | 55.49114412549 | 56.9042072630231 | 43.9997948689763 | 45.7071865134183 | 64.1230927685446 | 54.9417373194159 | 65.1062600694111 | 58.9077842416451 | 39.9892616886323 | 83.2652669467919 | 75.2444474902917 | 71.3407258450998 | 75.3051083089804 | 75.2854654078666 | 61.6427373733635 | 73.0901957753327 | 64.6156167984082 | 77.9780228287165 | 62.2497715440715 | 59.3512943530955 | 80.843956649729 | x | x | |||||||||||
0.84_168.8261m/z | 168.826132981733 | 1 | 0.842816666666667 | 0.0514166666666667 | 0 | 9.40348594449247E-5 | 12.7592354740098 | D0 MA | Blank | 100 | 12.5282362565236 | 18.47 | 0 | 3.92758211322088 | 0 | 0 | 15.1178522996751 | 11.0947004948341 | 7.38135449640849 | 8.36704445761424 | 3.06383650865522 | 2.61952149875013 | 6.14367988631025 | 8.10953416693027 | 18.1291615905787 | 7.7334687169685 | 10.6501569678714 | 13.6001577506756 | 14.0198870932863 | 12.387291064926 | 8.02016371205189 | 8.43444235243663 | 12.6507946288552 | 8.7261003414414 | 13.6519009833974 | 12.9083238250882 | 4.23116554085879 | 13.1184035043583 | 12.2919400115523 | 0 | 9.04453207504951 | 6.75394473453173 | 13.236732169954 | 9.59633106111569 | 9.74891586673617 | 11.7583061726129 | 15.9480242299168 | 11.9318016063877 | 0 | 2.63352441984549 | 0 | 0 | 17.9979617052488 | 12.8838958740244 | 8.36791992187352 | 8.36704445761424 | 2.90980529784945 | 2.42593263220096 | 5.70210689541658 | 7.36576843262063 | 19.10218714486 | 8.00941953155057 | 12.0239794254292 | 14.2501961901396 | 14.417272947159 | 12.0729452412554 | 7.7657568632651 | 9.47559290530325 | 12.6619612688186 | 9.20627503365637 | 12.9254686832436 | 11.813989719176 | 4.89015972241382 | 15.6758489676277 | 12.2187154319167 | 0 | 8.35033894001316 | 6.42108154296778 | 13.6121930397416 | 10.2904751632537 | 12.1260522594917 | 11.3130751238191 | 16.5533254448365 | 14.392992176731 | |||||||||||||
3.66_1083.8775m/z | 1083.87745105693 | 1 | 3.66001666666667 | 0.1543 | 0 | 1.00437703046907E-4 | 1.90964977686422 | Blank | D20 MA_VO | 100 - 67.1 - 10.4 | 135.437692117597 | 9.49 | 120.126103650393 | 141.430629197424 | 156.461374333962 | 123.732661288611 | 84.9731392541104 | 97.6468931187059 | 93.1228158362049 | 92.82637847243 | 82.4698998974471 | 94.3827360719306 | 104.150730457054 | 73.3170849463382 | 80.7176030289116 | 62.6483034277378 | 92.3543377367016 | 69.0093141174924 | 89.8199442581935 | 73.8430133703857 | 75.7249787964748 | 108.608858138856 | 101.941037950613 | 80.4775265141623 | 93.5854895733419 | 78.2217209630715 | 93.3730625095617 | 115.169158557763 | 87.2865108814288 | 86.3937271286411 | 63.1585205023939 | 76.6190076162594 | 67.4300426957527 | 76.483593415709 | 90.7269905485966 | 61.0153976684655 | 99.1847830440934 | 102.443581699825 | 74.3854320287763 | 94.832139715619 | 112.826874412132 | 83.5336383372928 | 101.161413404146 | 113.393994182103 | 105.569278131255 | 92.82637847243 | 78.3238109986596 | 87.4076274856133 | 96.6649645313004 | 66.5928102346137 | 85.0498657226412 | 64.8837621844451 | 104.267632875761 | 72.3077101861105 | 92.3658403133007 | 71.9691377394209 | 73.3229139606775 | 122.015574074832 | 102.031019560597 | 84.9059962786731 | 88.6057052536012 | 71.5902869958921 | 107.915699594682 | 137.62149751534 | 86.7665345342335 | 94.7453578220012 | 58.3109273944249 | 72.8428962602965 | 69.3427007563143 | 82.0159822986809 | 112.84949462868 | 58.7050351810713 | 102.949303890852 | 123.574772578563 | |||||||||||||
16.30_681.5293m/z | 681.529286297734 | 1 | 16.2950666666667 | 0.251433333333335 | 15 | 1.07205730179416E-4 | 3.62272084405767 | Blank | D6 MA_VO | 100 - 27.1 | 155.043286740899 | 17.28 | 191.055446720859 | 172.173530596562 | 115.500012055488 | 141.444157590688 | 67.323726838438 | 57.2599330740284 | 57.7117799265225 | 42.663649345109 | 74.1943640941669 | 51.1300673064373 | 70.3434123059138 | 63.7945575666021 | 45.2858954457144 | 33.3953968773886 | 59.8712317693795 | 63.4748202265043 | 59.9826209369232 | 34.2684830808332 | 31.8679354060555 | 46.7484772443347 | 50.2415019530917 | 17.8626461576751 | 50.8074966116925 | 52.2782353868137 | 85.7494502044793 | 87.1089771747243 | 36.5708826429455 | 74.7149303099378 | 27.811271928262 | 55.7813830416627 | 58.9567763489102 | 58.6960362912547 | 43.6292753910183 | 53.0010881051197 | 23.5573081547437 | 66.9392437248111 | 118.306858492163 | 115.445886096376 | 83.2889613187779 | 95.4909155113362 | 80.1496028320687 | 66.4940000699328 | 65.4253298915401 | 42.663649345109 | 70.4643191965018 | 47.3514337731149 | 65.287525356009 | 57.9436412282789 | 47.7164730152854 | 34.5870338140438 | 67.5943520026826 | 66.5086874684666 | 61.6827947600034 | 33.3988696614402 | 30.8570556640607 | 52.5191258414587 | 50.2858492672321 | 18.8455812931069 | 48.1039751992848 | 47.8462226207946 | 99.1047274231593 | 104.090956606256 | 36.353025453119 | 81.9375785966544 | 25.6766790174261 | 53.032238664723 | 60.6290895938724 | 62.9417742874713 | 54.2676622372335 | 50.9941893479486 | 24.4514168569085 | 80.7469016859713 | |||||||||||||
1.82_180.8525m/z | 180.852543664079 | 1 | 1.81998333333333 | 0.53715 | 0 | 1.07893989857666E-4 | Infinity | Blank | D0 MA | 100 - 1.01 | 896.259545663229 | 49.85 | 1280.29946570896 | 1285.42785011289 | 488.465776006187 | 530.845090824882 | 22.1327136566917 | 27.007673715921 | 17.2735357900603 | 12.9315516038659 | 0 | 0.128684769574097 | 2.77800599480874 | 0 | 0 | 0 | 0 | 0 | 90.3046762177323 | 0 | 0 | 8.78120131107339 | 0 | 21.5849543743566 | 0 | 0 | 2.58001525993787 | 53.4000050664563 | 0 | 0 | 7.92240595999667 | 144.818602848269 | 0 | 184.198787187744 | 1.3065454768337 | 1.28357126083866 | 0 | 0 | 792.797118935447 | 861.905756680843 | 352.240717548853 | 358.380894488806 | 26.3492277163558 | 31.3630869186209 | 19.5822547649176 | 12.9315516038659 | 0 | 0.119174659160467 | 2.57833862304648 | 0 | 0 | 0 | 0 | 0 | 92.8643117289677 | 0 | 0 | 9.86515591267381 | 0 | 22.7727184863458 | 0 | 0 | 2.98184662961697 | 63.8103877513923 | 0 | 0 | 7.31433914296671 | 137.681324674309 | 0 | 197.522681594163 | 1.62512826534343 | 1.23496853096623 | 0 | 0 | |||||||||||||
15.66_1816.5031m/z | 1816.50310310826 | 1 | 15.65505 | 0.10285 | 0 | 1.09700635156806E-4 | 3.53015674042022 | D20 MA_VO | Blank | 82.6 - 100 - 55.2 - 13.1 - 0.334 | 364.403800059156 | 26.06 | 57.5140390270443 | 121.954308129964 | 128.956092497097 | 104.47937947295 | 186.510673902783 | 229.61366810845 | 245.3211934396 | 318.055880451451 | 388.37237980891 | 378.412789406563 | 394.380571303847 | 427.847342196519 | 201.869452442388 | 133.780995890813 | 194.098401998865 | 32.8075201640884 | 344.433996146622 | 289.770448391901 | 191.455663434012 | 443.710498563014 | 255.12081842832 | 439.925012416007 | 239.146306081084 | 255.604500626715 | 291.158793688376 | 256.979211519748 | 443.206443460783 | 416.757062416062 | 410.056023707798 | 495.729468382632 | 288.737965337484 | 263.091742808709 | 244.536931867261 | 459.926026573105 | 403.517862865642 | 276.692863136293 | 35.6142962332118 | 81.7728666918286 | 92.9923625865215 | 70.5354803469457 | 222.042913238051 | 266.642492290756 | 278.109946194815 | 318.055880451451 | 368.847360201468 | 350.447184610465 | 366.034724572958 | 388.607333326604 | 212.7041584421 | 138.554659060959 | 219.1362248635 | 34.3756011820522 | 354.196785015805 | 282.417094878391 | 185.382516579985 | 498.482279741665 | 255.346009209622 | 464.132945991021 | 226.421074524612 | 233.935016156792 | 336.506097899564 | 307.077557590396 | 440.566208844954 | 457.044722062531 | 378.58307692888 | 471.297806667298 | 296.92803870411 | 282.122305679957 | 304.163832751479 | 442.510818619459 | 418.833230406668 | 333.76671401794 | x | x | |||||||||||
17.41_1056.8952n | 1056.8951744448 | 1101.89556867905 | 1 | 17.4093666666667 | 1.41718333333333 | 0 | 1.09718651055357E-4 | 1.90465062209026 | Blank | D6 MA_VO | 100 - 85.5 - 41.5 - 3.75 | 4969.83758331064 | 8.38 | 6503.9985755974 | 6290.78429328451 | 3364.18188825652 | 3720.38557610413 | 3225.7128042344402 | 3299.58822911783 | 3026.50355572926 | 2743.94373351989 | 2773.88687433404 | 2654.24236782355 | 2692.15550214888 | 2476.38293465448 | 2608.78867583673 | 2619.59114717071 | 2774.00745819141 | 3399.03177757027 | 2567.45625044343 | 2373.93970406018 | 2950.52729484505 | 2947.96190190079 | 2775.84422207093 | 2142.8983918337 | 2733.70364974761 | 2784.82244205186 | 2711.55847805002 | 3024.0241051082 | 2584.80183239945 | 2410.69685915211 | 2955.36504260735 | 2828.14794356551 | 2160.27752597669 | 3028.21263083906 | 2912.15182771503 | 2527.33304807033 | 2420.88856138176 | 2762.13460580383 | 4027.45722418823 | 4218.09998588653 | 2425.96697761139 | 2511.68398022784 | 3840.24492182595 | 3831.69885396227 | 3431.01518968239 | 2743.94373351989 | 2634.43258142875 | 2458.08754650259 | 2498.65857863832 | 2249.26153237517 | 2748.80717777494 | 2713.06515442281 | 3131.84197227349 | 3561.49322492153 | 2640.22936106655 | 2313.69747452784 | 2856.93389971111 | 3311.85936372968 | 2778.29441227097 | 2260.81653802553 | 2588.24034521296 | 2548.73244163491 | 3133.87739767766 | 3613.56053199559 | 2569.40385393219 | 2643.73750400475 | 2728.53250919592 | 2688.76475526414 | 2221.55395496774 | 3247.25633872385 | 3622.2392041495 | 2431.63498347456 | 2512.77246914762 | 3331.88424379515 | M-H, M+FA-H | |||||||||||
13.73_473.3916m/z | 473.391571095396 | 1 | 13.7346166666667 | 0.154400000000001 | 0 | 1.16781487738749E-4 | 2.65763519314141 | Blank | D0 MA | 100 | 77.2175342482708 | 11.84 | 83.7979762118931 | 88.4796355504234 | 74.1046056283796 | 62.4879196023873 | 26.7775543565889 | 38.6497618209269 | 36.2740358923534 | 39.6144699326535 | 35.0626518968107 | 44.8981971429933 | 34.6169523568389 | 37.0789707587596 | 29.8202099678741 | 33.668492565356 | 28.5976582973014 | 24.1335544498607 | 26.403164131907 | 18.2410616082242 | 58.1430867388253 | 34.4127173356571 | 33.7386184623451 | 22.4890824738425 | 42.2580147786602 | 33.5494772437508 | 34.0851077882569 | 37.3599861578647 | 34.0964095543214 | 27.9082481472061 | 43.1168022186679 | 42.999674532293 | 30.0744772580546 | 47.1588346644505 | 38.5118289231404 | 32.0171270941895 | 20.9579102894929 | 40.9180840813752 | 51.8900428319887 | 59.3274116654897 | 53.4380518398583 | 42.1864625083926 | 31.8789592805098 | 44.8826452853344 | 41.1222937115499 | 39.6144699326535 | 33.2999133464768 | 41.5801136307333 | 32.1288814497114 | 33.6782738326285 | 31.4207156607492 | 34.869874285408 | 32.2866278891035 | 25.287051222538 | 27.1515470435301 | 17.7781677030266 | 56.2987354254308 | 38.6606353582767 | 33.768398963593 | 23.7265984125247 | 40.0094204683935 | 30.7052398601172 | 39.3937839658329 | 44.6433516280225 | 33.8932931012349 | 30.6061220504475 | 39.8074670472565 | 40.8804672447577 | 30.9275419907041 | 50.5700370018387 | 47.9023982270709 | 30.8047909918424 | 21.7533598309232 | 49.3583185086461 | |||||||||||||
17.41_702.6034n | 702.60337071474 | 737.595671941601 | 1 | 17.4093666666667 | 1.85718333333333 | 2 | 1.18654999416656E-4 | 1.95815457008094 | Blank | D20 VO_MA | 100 - 47.2 - 17.2 | 7106.24345376256 | 3.3 | 8984.63064711738 | 7723.91028283637 | 5590.94378710913 | 6125.48909798735 | 4516.86978066941 | 4695.56403574732 | 4367.15819589891 | 4435.48495517765 | 4446.57103780545 | 4819.45104803996 | 4612.5482507317 | 4510.95751551481 | 3375.62819337127 | 4111.59666248875 | 2766.79470820029 | 4860.50217034426 | 4345.75869910069 | 3995.73381266156 | 4736.40434180142 | 4315.24072793949 | 4094.23828789164 | 3591.67564143606 | 3922.21744686511 | 4655.10311882542 | 3782.50025514564 | 4682.8188075973 | 3564.47331603415 | 2838.73931678552 | 4264.91712078862 | 4691.98609970253 | 2735.32938308321 | 4810.12195819492 | 4367.85681126099 | 2871.48466782428 | 3498.11331464694 | 3778.75054029066 | 5563.53375324536 | 5179.04037653949 | 4031.72166420453 | 4135.40277580211 | 5377.38084276896 | 5452.79776903851 | 4950.85693109804 | 4435.48495517765 | 4223.02427904328 | 4463.28215756724 | 4281.02434902982 | 4097.23515367458 | 3556.80438717879 | 4258.30941064498 | 3123.69880989987 | 5092.81662608393 | 4468.93679746027 | 3894.33616002498 | 4586.16131105542 | 4847.91557257208 | 4097.85220197582 | 3789.31624585039 | 3713.51204788116 | 4260.45558917729 | 4371.61586307941 | 5595.73886763538 | 3543.23931554736 | 3113.15857379029 | 3937.57280245535 | 4460.74502070236 | 2812.9171997846 | 5158.05886935202 | 5432.897429759 | 2762.75522061627 | 3630.88287962605 | 4558.1990682032 | M+Na-2H, M+Cl | |||||||||||
14.02_703.4823m/z | 703.482347094348 | 1 | 14.02055 | 0.2401 | 12 | 1.19021548176113E-4 | 2.87686108046366 | Blank | D6 VO_MA | 100 - 18.7 | 231.900282717076 | 10.04 | 223.633316944068 | 276.171469328223 | 211.914262466186 | 215.882082129826 | 91.4460864927636 | 120.843903954902 | 93.6280171413251 | 116.027538013382 | 106.622503061784 | 110.308916520468 | 115.778212496108 | 116.013912821698 | 97.7192380518597 | 126.299182490689 | 60.3212197971863 | 118.471386778437 | 120.954826402993 | 136.299387868362 | 134.343978051563 | 70.7938148120999 | 112.139891530947 | 81.9105020453871 | 119.241243007932 | 136.499326450383 | 67.8786735295053 | 108.589394168016 | 79.3085097573702 | 66.6585714535863 | 150.272721271838 | 125.508217668538 | 64.8158621791383 | 138.259930341661 | 127.178844572773 | 78.0372949174424 | 110.46024603889 | 117.607994034553 | 138.479983878661 | 185.178638555324 | 152.814865516761 | 145.74499234338 | 108.867524974232 | 140.331888750895 | 106.142002834794 | 116.027538013382 | 101.262167025787 | 102.156825335245 | 107.456728870936 | 105.373699551269 | 102.964009868487 | 130.805874579956 | 68.1023864668094 | 124.133891345986 | 124.383223268842 | 132.840589401392 | 130.082465526797 | 79.5326283994453 | 112.238875494485 | 86.4178247405007 | 112.89628851868 | 124.927268730667 | 78.4506188896339 | 129.759001687857 | 78.836059331884 | 73.1024162769306 | 138.738869589459 | 119.322637604927 | 66.6543688193986 | 148.260868679184 | 158.189621971528 | 75.082394258192 | 114.652722809915 | 141.867170935372 | |||||||||||||
3.64_750.5290n | 750.529008328493 | 731.511167208493 | 1 | 3.64286666666667 | 0.777166666666667 | 13 | 1.19308665441298E-4 | 1.29212928530934 | Blank | D6 VO_MA | 100 - 39.6 - 41 - 13.8 - 4.82 - 0.278 | 2210.47554700941 | 1.64 | 2530.63225395544 | 2453.93710588117 | 1926.09344980761 | 1931.23937839341 | 1987.320668795 | 1956.46242127155 | 2060.1005101637 | 1997.16765672887 | 1986.71925365913 | 1922.13145377757 | 1945.53231009137 | 1897.30107991446 | 1843.74028249235 | 1829.97542556569 | 1840.74601821378 | 1897.88669042898 | 1786.87338758864 | 1734.73813361823 | 1731.4584564777 | 1819.06832861087 | 2012.4838342909 | 1706.18876961889 | 1892.6363340607 | 1999.74424463705 | 1679.63806672435 | 1776.66272551609 | 1661.19959547716 | 1725.39241609406 | 1935.96753165574 | 1868.27839908336 | 1721.98366826596 | 1731.39376795222 | 1830.49601801884 | 1762.44154126244 | 1637.85497963597 | 1839.34425416203 | 1567.03803583174 | 1645.41519612007 | 1388.93771509139 | 1303.8065301219 | 2365.92609743849 | 2271.97283323159 | 2335.44617162723 | 1997.16765672887 | 1886.83899852548 | 1780.08136956454 | 1805.69844228819 | 1723.29015624593 | 1942.69722550152 | 1895.27383535198 | 2078.19399443714 | 1988.59882223971 | 1837.52131379266 | 1690.71658890705 | 1676.53502778811 | 2043.61476771104 | 2014.26021933777 | 1800.07591682732 | 1791.92712387977 | 1830.21113099182 | 1941.237784911 | 2123.02484386544 | 1651.30362771655 | 1892.18508425718 | 1787.37660854585 | 1776.20167428144 | 1770.82786013642 | 1856.63296247859 | 2276.83679690213 | 1695.70627477638 | 1700.01914459731 | 2218.74854559237 | x | M-CO2-H, M-H2O-H, M+Na-2H | ||||||||||
13.03_668.5236n | 668.523581197807 | 667.516304765807 | 1 | 13.0260333333333 | 0.285733333333333 | 0 | 1.42885418765726E-4 | 1.56260512581361 | D20 MA_VO | Blank | 100 - 34.5 | 419.134863884133 | 5 | 326.082095373744 | 314.760198461062 | 232.984711530067 | 199.086060028793 | 370.644413496804 | 361.580407986822 | 400.53772326115 | 371.075075222488 | 450.19148455246 | 431.91944391498 | 436.082702850135 | 425.605938938975 | 378.95799404292 | 365.409654568394 | 309.63619645305 | 361.338758056332 | 332.190002578992 | 408.184448414958 | 315.417692340418 | 297.022159583807 | 356.163451455859 | 407.422411796298 | 392.131601353131 | 325.892591252675 | 366.140851575942 | 351.584918635775 | 389.437885316906 | 389.719756788651 | 443.687718807075 | 371.69895728004 | 446.795269219952 | 414.357510229466 | 336.681703627892 | 397.983064348656 | 415.276105058951 | 358.884739358594 | 201.919123355711 | 211.053173465759 | 168.009113429113 | 134.405764518802 | 441.256061254364 | 419.890949625774 | 454.07216190059 | 371.075075222488 | 427.558573408483 | 399.999570141107 | 404.739542571943 | 386.571500315811 | 399.29736883202 | 378.448446800533 | 349.577876340328 | 378.609446140309 | 341.605742302464 | 397.826164592127 | 305.412357781057 | 333.686680217466 | 356.477830840492 | 429.841811474374 | 371.265858078231 | 298.264265351927 | 423.166436722199 | 420.126738897692 | 387.117956532702 | 427.393736032057 | 409.633445358758 | 353.380047948632 | 459.468649495717 | 444.329779846947 | 418.776814654504 | 382.913341334058 | 431.037752225736 | 432.912431528455 | x | M-H, M+FA-H | ||||||||||
0.86_425.1410m/z | 425.140951037652 | 1 | 0.859966666666667 | 0.102866666666667 | 0 | 1.43145700388758E-4 | 2.98417420566736 | D20 MA_VO | Blank | 100 - 11.5 | 42.7339043801021 | 14.7 | 4.36883918054726 | 19.9361902919563 | 16.1735025665296 | 16.8021780467849 | 20.3880095400377 | 28.7905801859682 | 23.8440147815516 | 26.9854936893144 | 28.9049894725908 | 32.5059639989535 | 31.4494935651456 | 30.9079318910302 | 38.8269025588414 | 44.2120165997569 | 36.0621701988402 | 29.8319307286199 | 31.5995228102686 | 42.4839489375726 | 57.3206082635882 | 29.8062008912725 | 44.1459426358234 | 26.4766633936347 | 51.875461010283 | 36.0560850635859 | 42.4284587955084 | 21.3977504669074 | 32.6840364209584 | 41.42349320059 | 39.9624315100548 | 38.2431197742425 | 40.2678423101102 | 52.462223926001 | 37.3064354569388 | 42.041874334142 | 36.4832753194457 | 25.4180149995749 | 2.70530700683548 | 13.36762477755 | 11.6629791259735 | 11.3433837890636 | 24.2721391685861 | 33.4335151671264 | 27.0309204638625 | 26.9854936893144 | 27.4518210302754 | 30.1036959780007 | 29.189081695934 | 28.0732116486928 | 40.9108140621166 | 45.7896194118365 | 40.7140283298421 | 31.2577893144196 | 32.4951936006521 | 41.4058559266339 | 55.5023467115244 | 33.4854888916033 | 44.1849095040496 | 27.9336055783974 | 49.1151120662741 | 32.9993439912812 | 49.0365924666181 | 25.5692626358678 | 32.4893336461751 | 45.4278778791803 | 36.8952031135555 | 36.3583357844754 | 41.4100425831157 | 56.2570433305581 | 46.4030864713625 | 40.4499488026701 | 37.8679842060602 | 30.6610269853182 | |||||||||||||
0.86_220.1371m/z | 220.137112759659 | 1 | 0.859966666666667 | 0.10285 | 0 | 1.43291599693729E-4 | 2.45116131644708 | QCs | Blank | 100 | 79.8730563195016 | 8.33 | 45.1200192561516 | 30.3445873368269 | 28.4789558413747 | 26.3996439202189 | 75.528681359459 | 78.2094578252074 | 70.5344885994116 | 73.9140845537101 | 82.6743977167418 | 81.7211324598712 | 91.0037667820752 | 85.3984412595363 | 44.1493790118743 | 50.6257924892713 | 81.5788922279816 | 54.2657373369179 | 61.1389360753022 | 74.2930580856115 | 49.0946205194078 | 36.7181052591304 | 89.4152071647459 | 29.5059573849834 | 79.3814047233066 | 41.5144404295537 | 27.7143179483517 | 21.7874802241527 | 37.603785686905 | 48.6288927857743 | 46.8958152614197 | 67.2076740865194 | 53.3772409033788 | 55.7966666440017 | 49.9264722901167 | 62.3620634127621 | 40.7745687699329 | 40.2433100072794 | 27.9395736940193 | 20.3466686266512 | 20.5366441895427 | 17.8227663132616 | 89.9176872355535 | 90.8219659875492 | 79.9618759155058 | 73.9140845537101 | 78.5180279016509 | 75.6817464828637 | 84.4629303087926 | 77.5661252393004 | 46.5189576473544 | 52.4322559518601 | 92.1022032499307 | 56.8594436645596 | 62.8718850038845 | 72.407761904669 | 47.5372947406389 | 41.2506011839753 | 89.4941324382133 | 31.1295937691029 | 75.1574349997703 | 37.994954192183 | 32.030758441489 | 26.0349705865905 | 37.3797753681886 | 53.3298191964275 | 43.2964302687769 | 63.8953933715692 | 54.891290220017 | 59.832680702211 | 62.1003422737206 | 60.0007091079321 | 42.3221520729459 | 48.5443577766538 | x | ||||||||||||
13.03_576.3719n | 576.371942716499 | 531.287297037976 | 1 | 13.0260333333333 | 0.251433333333333 | 0 | 1.4574690353053E-4 | 1.80086082298387 | D20 MA_VO | Blank | 100 - 42.8 - 26 | 198.399481272343 | 6 | 134.65221388708 | 121.846262550335 | 97.5902795183677 | 86.588233049093 | 172.543292257523 | 178.131021286424 | 177.342848137902 | 187.703563267666 | 188.736524009097 | 178.146935486082 | 195.912154330621 | 205.513804102732 | 177.96570323856 | 144.59192782449 | 191.604238127296 | 174.129976625846 | 165.358954245648 | 185.932445037871 | 117.453951188562 | 164.876291535567 | 164.010116335568 | 223.592609910733 | 205.234309214494 | 124.13486950538 | 176.373152202216 | 176.616587602027 | 189.671007714607 | 148.822183863041 | 177.379419518195 | 187.12629645439 | 221.09688780118 | 207.995321315607 | 149.031891257101 | 186.248426294867 | 175.794176329864 | 186.952110720537 | 83.3804044187768 | 81.7004199130709 | 70.3739581601877 | 58.456918880269 | 205.414598911989 | 206.857456968441 | 201.045858542223 | 187.703563267666 | 179.247990520358 | 164.981453417538 | 181.831095821541 | 186.665110420355 | 187.517450911588 | 149.751353914572 | 216.320325044759 | 182.452760842385 | 170.045961265831 | 181.214134369608 | 113.728205596295 | 185.228679389313 | 164.154885259039 | 235.896331899299 | 194.313571399705 | 113.611038272647 | 203.842860007643 | 211.048162339828 | 188.541114484091 | 163.208736682469 | 163.765052925815 | 177.903914763157 | 227.368317088658 | 223.040521886953 | 185.371227572151 | 179.196085510563 | 182.466377661779 | 225.515002326517 | M-CO2-H, M-H2O-H | |||||||||||
0.84_479.0424m/z | 479.04236021676 | 1 | 0.842816666666667 | 0.0857333333333333 | 4 | 1.47646587579708E-4 | 188.368915257481 | Blank | D6 VO_MA | 100 - 17.8 | 162.73594002018 | 20.02 | 183.809518012157 | 197.289238147095 | 134.738135629085 | 135.106868292384 | 6.06931819124162 | 4.64336550006151 | 15.0531817490412 | 0.56011391030438 | 4.10182228216465 | 0 | 0 | 0.0160710754668075 | 0 | 10.9139073681459 | 0.0406884956502794 | 9.72572219491516 | 14.6315304078449 | 0 | 0.147346045586983 | 0 | 0.174086333615591 | 6.93167548209042 | 0 | 10.289530443366 | 1.91513211545633 | 1.25880807322244 | 0 | 0.281745475757676 | 4.30666892051377 | 13.1421779256118 | 1.81403856187361 | 4.13607357420605 | 11.3991027623564 | 3.33777522713286 | 3.0110523429525 | 0 | 113.819977447431 | 132.286483504481 | 97.1618891362872 | 91.2125234783018 | 7.22558695624271 | 5.39218139648608 | 17.065136149019 | 0.56011391030438 | 3.89560741043533 | 0 | 0 | 0.0145971171604896 | 0 | 11.3033447265599 | 0.0459371290044383 | 10.1905766027936 | 15.0462529491819 | 0 | 0.142672095717026 | 0 | 0.174239996643651 | 7.31310762370123 | 0 | 9.41721082615029 | 2.21340948343158 | 1.5042139257654 | 0 | 0.30898164487849 | 3.97612003476849 | 12.4944753665349 | 1.86549389749 | 4.43525365243171 | 14.1786140835706 | 3.21138957743141 | 3.12533569336006 | 0 | |||||||||||||
16.20_1354.0900m/z | 1354.08995375974 | 1 | 16.1979166666667 | 0.0971499999999992 | 0 | 1.50776795856511E-4 | 3.43334646583536 | Blank | D6 MA_VO | 100 - 77.1 - 15.4 | 112.221176696229 | 11.52 | 146.878414806671 | 144.825606966341 | 83.2825178137346 | 73.8981671981702 | 27.1725402725678 | 34.3314403199899 | 42.3890147432755 | 35.6693821784231 | 20.7759779119696 | 32.0407744363388 | 41.134617327654 | 35.2714235838787 | 50.627131994432 | 25.8608283961888 | 28.9837809535659 | 33.6441294628257 | 47.9076062819077 | 55.3079614172075 | 28.3478299284339 | 64.9177207803307 | 28.8280085998998 | 14.9755935928267 | 64.9915576855122 | 21.9474585122125 | 55.9661679783691 | 42.9898648926423 | 50.5196501775721 | 42.1767600085437 | 48.6279686889796 | 53.180883186149 | 23.9373369618839 | 50.1452252672355 | 37.8484555067602 | 42.178519152895 | 47.5755884548955 | 37.3508603985654 | 90.9512088471067 | 97.1085419909981 | 60.0563955039779 | 49.8896791536877 | 32.3491941557409 | 39.867926357632 | 48.0545787512893 | 35.6693821784231 | 19.7314871160624 | 29.67288503003 | 38.1780934952335 | 32.0365058041389 | 53.3443835851593 | 26.7836118097995 | 32.7225586353472 | 35.2521973848359 | 49.2655205719915 | 53.9044401310676 | 27.4486111168279 | 72.9311872381051 | 28.8534545898428 | 15.7996617060503 | 61.5332871635185 | 20.0868100877185 | 64.6827683348259 | 51.3707806725029 | 50.2186984853158 | 46.2539625455906 | 44.8956360758005 | 50.5599025291673 | 24.6163212641052 | 53.7724461444596 | 47.0772705077898 | 40.5814195329896 | 49.3813018822832 | 45.0552782593139 | |||||||||||||
4.00_743.4696m/z | 743.46955278656 | 1 | 3.99716666666667 | 0.302866666666667 | 58 | 1.60147370275365E-4 | Infinity | D20 VO_MA | Blank | 100 - 38.3 | 194.807405003781 | 30.87 | 0 | 0 | 0 | 0 | 50.7762996276167 | 34.4851175641144 | 53.9603669717399 | 23.9117429256419 | 25.0115362539605 | 28.2379104930721 | 41.299818228965 | 45.2669805090763 | 0 | 0 | 3.16208358702633 | 0 | 356.010393855203 | 192.337197380546 | 43.3268027164192 | 0 | 12.235630799411 | 0 | 0 | 0 | 53.0577220434462 | 75.6257788973169 | 0 | 4.29768052200145 | 26.7485541094171 | 11.8777012725543 | 0 | 0 | 6.46349571508232 | 292.183876994308 | 359.359734493409 | 121.222512812326 | 0 | 0 | 0 | 0 | 60.4497172029999 | 40.0463864803212 | 61.1725165068457 | 23.9117429256419 | 23.7541071442718 | 26.1510617733043 | 38.3314206893462 | 41.1153204623615 | 0 | 0 | 3.5699781802832 | 0 | 366.10130923907 | 187.456356653047 | 41.9524373365046 | 0 | 12.2464309813656 | 0 | 0 | 0 | 61.321338717281 | 90.369097707636 | 0 | 4.71313476562216 | 24.6955277636839 | 11.2923175139619 | 0 | 0 | 8.0395284861894 | 281.120265272935 | 372.999097009175 | 146.227261909671 | x | x | |||||||||||
1.10_155.8639m/z | 155.863866008544 | 1 | 1.09995 | 1.24575 | 0 | 1.63016198875932E-4 | 1.49764796112155 | D6 MA_VO | QCs | 100 | 235.853638373589 | 7.54 | 255.893922248491 | 208.494602353745 | 231.216111191183 | 242.006467496068 | 144.899799512333 | 149.458182005599 | 151.525170486827 | 176.90425485504 | 158.540046161389 | 147.92396581401 | 157.066781778547 | 173.543366303302 | 206.403642915569 | 195.628460323054 | 238.666740639785 | 252.303679070819 | 154.90548966117 | 187.870266386648 | 235.37433885009 | 182.461850601499 | 277.656426309272 | 187.359267677355 | 268.507323331836 | 209.891536175892 | 174.404852407768 | 149.323532235733 | 188.410278711563 | 196.525935223105 | 204.020546080658 | 167.240081609683 | 187.604779913947 | 140.144252460326 | 180.607124717096 | 267.370680032354 | 206.468192717981 | 192.88088943405 | 158.456649983335 | 139.799910193165 | 166.733746590685 | 163.381927783388 | 172.504730898664 | 173.560670283772 | 171.777482493076 | 176.90425485504 | 150.569609356926 | 136.992033057949 | 145.777709124463 | 157.626840567521 | 217.481707284412 | 202.60900617606 | 269.453679194044 | 264.36288403159 | 159.296199077657 | 183.102780636859 | 227.908051878648 | 204.985006098073 | 277.901508886065 | 197.66916272444 | 254.219760542355 | 192.097477885135 | 201.568002103007 | 178.434299407118 | 187.287895796847 | 215.523981576709 | 188.361398507257 | 158.997777369704 | 192.926203127652 | 150.281491960957 | 224.645638827249 | 257.246625892245 | 214.304614715636 | 232.666719096219 | x | ||||||||||||
6.96_163.0187m/z | 163.018694346719 | 1 | 6.96293333333333 | 0.2057 | 0 | 1.682183438384E-4 | 10.7469894276438 | D6 MA_VO | Blank | 100 | 57.2638731848247 | 16.65 | 0 | 6.48240895402433 | 8.2410180696235 | 6.59002957565923 | 6.30977712675243 | 18.8685293444146 | 7.14141357628323 | 41.2789759636018 | 45.1898495533161 | 47.8919882428391 | 46.0053423586298 | 117.056799728822 | 45.3001196800248 | 52.6256091796413 | 34.96151579412 | 42.5304713538084 | 49.1591627875363 | 65.4454660721758 | 57.1917373655643 | 26.7856758806846 | 63.0899485643212 | 54.8035268109369 | 67.2121293848182 | 43.9498879792224 | 53.080327601431 | 28.9187940661778 | 44.9965656317813 | 23.0805666545084 | 61.4085109473404 | 82.2831263980605 | 32.4166509405501 | 34.7824299927417 | 40.3100842959558 | 42.2686398659784 | 61.2912413128414 | 48.5684461682922 | 0 | 4.34658825397499 | 5.94273388385859 | 4.44902050495094 | 7.51185584068614 | 21.9113771915341 | 8.09590935706922 | 41.2789759636018 | 42.9179766178104 | 44.3526564507003 | 42.6987383365592 | 106.320938110373 | 47.7314606904976 | 54.5034314418735 | 39.4713944459671 | 44.5632743356064 | 50.5525517463782 | 63.7846906185163 | 55.3775637149752 | 30.0921092033362 | 63.145636982448 | 57.8192228938437 | 63.635699859976 | 40.2239308357234 | 61.3474650382892 | 34.5565409660349 | 44.7285156250016 | 25.311751432599 | 56.6952359676379 | 78.2278631198931 | 33.3361515998869 | 37.298393487928 | 50.1391329496542 | 40.6681278039222 | 63.6175271458539 | 58.5867322301085 | |||||||||||||
12.79_318.0151m/z | 318.015093562038 | 1 | 12.7917333333333 | 0.285716666666666 | 0 | 1.76369816488275E-4 | 1.83401575762025 | Blank | D0 MA | 100 - 2.45 | 102.248209840237 | 6.13 | 108.588853717401 | 97.1988790187767 | 88.7863165402548 | 114.418790084515 | 59.0134474376318 | 51.2310255499198 | 48.7991297001254 | 54.8381091715014 | 77.712545964282 | 72.7884642196389 | 65.5901527979634 | 77.3758891470334 | 59.3591257826064 | 63.4525175325335 | 44.7928719273651 | 55.3994789498035 | 67.6156113392449 | 68.2904380491934 | 59.6316808487854 | 66.8635296365511 | 58.8189918883583 | 55.629136832816 | 49.6336818352947 | 69.3813125457267 | 39.9090504849868 | 55.0146164637961 | 69.0487210842196 | 62.8596524727073 | 52.7024890498258 | 63.0125034421218 | 65.1012542047135 | 49.3389017067326 | 57.3549256465188 | 69.9052088486661 | 69.3548105551547 | 50.5026087483258 | 67.2412452566224 | 65.1738433719566 | 64.0252754294558 | 77.2457145136196 | 70.2561280546467 | 59.4928361528984 | 55.3214467326365 | 54.8381091715014 | 73.805628112803 | 67.4092236625913 | 60.8759032797379 | 70.2793613040428 | 62.5450395921169 | 65.716672796001 | 50.5709514033734 | 58.0473740333631 | 69.5321380037172 | 66.5574672257192 | 57.7401099834923 | 75.1171874290663 | 58.8709104061034 | 58.6902640960477 | 46.9926203666714 | 63.4993454010709 | 46.1247921776776 | 65.7397692037694 | 68.6373894660198 | 68.9362580367121 | 48.6574256021939 | 59.9069786223909 | 66.947856010516 | 52.9077977157989 | 71.3401197872675 | 67.2582315549184 | 71.9871461024513 | 60.9198574195222 | |||||||||||||
2.83_242.9263m/z | 242.926303100621 | 1 | 2.83143333333333 | 0.4343 | 0 | 1.76432311918884E-4 | 1.5091520764767 | Blank | D20 VO_MA | 100 | 136.35284912733 | 3.42 | 146.361136519075 | 145.30086399151 | 131.018653304504 | 122.730742694231 | 84.2817928451504 | 80.9357637506857 | 81.509714002592 | 106.559545756987 | 103.860005608709 | 104.271966398969 | 108.045207386512 | 97.5022508734521 | 92.6789110846517 | 111.580806652158 | 85.9266693406365 | 76.7151533941448 | 105.99997800675 | 103.939339484513 | 97.9570148327412 | 101.080639292675 | 103.972527209528 | 89.0802561426948 | 91.6763678228147 | 109.380721336396 | 87.9551327032708 | 86.1428558099497 | 88.5045820625494 | 99.9710677967077 | 105.867394333527 | 115.892550796279 | 106.364996863482 | 109.299250338511 | 76.1018845242284 | 104.766764167701 | 104.177905834708 | 76.3559873448536 | 90.6308957117206 | 97.4272115809407 | 94.4797091611973 | 82.8572291771342 | 100.338358254057 | 93.9879317277647 | 92.4040106677402 | 106.559545756987 | 98.6385512742458 | 96.5660201802942 | 100.279528467645 | 88.5598342407607 | 97.6531592525974 | 115.562307788877 | 97.0108240999915 | 80.3818607595865 | 109.004488063816 | 101.301725085143 | 94.849729700555 | 113.558069226531 | 104.064301980323 | 93.9821118287462 | 86.7981699199543 | 100.107708394541 | 101.653939835641 | 102.936488946104 | 87.9773495173805 | 109.635212011898 | 97.7417756988983 | 110.180871791963 | 109.382047728042 | 117.205337519893 | 94.6582616365884 | 100.799745823022 | 108.131938764458 | 92.1060511023508 | |||||||||||||
3.64_433.1550n | 433.155016754826 | 454.129684574826 | 1 | 3.64286666666667 | 0.388566666666666 | 0 | 1.93665866869419E-4 | 1.81093884019047 | Blank | D20 MA_VO | 100 - 29 | 740.954977499369 | 4.24 | 937.240062518473 | 931.465613881711 | 543.992548755557 | 551.121684841733 | 589.102159611853 | 569.249639904111 | 574.362137544268 | 507.896638471509 | 473.975463336303 | 447.147715758491 | 439.254893771599 | 461.869918473799 | 523.718233126413 | 521.530155764002 | 487.416715379856 | 539.548422033531 | 430.482110767882 | 394.254649354111 | 460.59957747112 | 496.695712225655 | 554.905236674886 | 426.090263084764 | 495.280978522321 | 442.738366117113 | 424.213938331225 | 481.690526220915 | 417.78968534365 | 417.099044169364 | 416.837658140624 | 415.985341821566 | 426.088046740975 | 377.709607855079 | 565.291703932853 | 423.267890722107 | 463.945903004292 | 490.720451155154 | 580.365173318314 | 624.566812275301 | 392.281988068004 | 372.069904760435 | 701.332298993379 | 661.050119402981 | 651.129325310833 | 507.896638471509 | 450.146837264488 | 414.102436490869 | 407.683734336745 | 419.509529825331 | 551.827157057008 | 540.139744368973 | 550.291284440009 | 565.336888660436 | 442.683885291898 | 384.249854775732 | 445.988942169391 | 558.008006954995 | 555.395042032853 | 449.536906250309 | 468.926546206417 | 405.204159460773 | 490.284271527899 | 575.596560638463 | 415.30086144306 | 457.419762990409 | 384.844201950215 | 395.483810647555 | 438.174065146528 | 405.030976297215 | 703.130156978347 | 407.240751766849 | 481.55479390494 | 591.94209285687 | x | x | M+Na-2H, M+Cl | |||||||||
3.66_674.5289n | 674.528915338252 | 655.511074218252 | 1 | 3.66001666666667 | 0.251433333333333 | 0 | 1.9633053665935E-4 | 1.56641488828322 | D0 MA | Blank | 100 - 31.3 - 15.9 - 4.01 - 0.406 | 5067.04777893898 | 6.29 | 2950.9816403255 | 3133.98503131918 | 3336.5301349959 | 3517.72591612714 | 3819.6267142022 | 3818.16909937784 | 4064.97894333427 | 4497.42456215744 | 4511.76812878767 | 4748.49869564648 | 4867.32720462478 | 4896.08522058454 | 5821.89968548569 | 5615.38133822831 | 4684.65211138779 | 4146.25798065412 | 5612.16337363456 | 4071.76642607266 | 4262.81131051936 | 4310.74742406708 | 5284.88007848413 | 5281.12993735212 | 5092.7169522274 | 4608.43497479056 | 4467.43793065557 | 4839.16770751759 | 4516.11449172004 | 5364.62632203024 | 4362.61450864336 | 5116.75517442358 | 5213.2586426918 | 3689.97417657038 | 4592.55397117386 | 4399.50193409205 | 4387.98070809726 | 5329.1673492666 | 1827.33009357772 | 2101.40128799012 | 2406.02684282929 | 2374.86562874513 | 4547.30566007936 | 4433.90906574777 | 4608.28948108019 | 4497.42456215744 | 4284.94365372548 | 4397.57335270158 | 4517.49123153096 | 4447.04088038305 | 6134.37178410626 | 5815.75313918653 | 5288.95121194428 | 4344.43414278177 | 5771.23700379048 | 3968.43933346707 | 4127.59107918515 | 4842.86761367739 | 5289.54495170494 | 5571.7368342465 | 4821.72801858822 | 4217.74384896131 | 5163.23098680784 | 5782.56813695852 | 4489.21144916275 | 5883.22158743374 | 4027.77164252487 | 4864.57966444318 | 5361.13310288943 | 3956.88595727024 | 5712.38384044387 | 4232.91375110627 | 4554.52485271129 | 6428.42267218239 | M-CO2-H, M-H2O-H, M-H | |||||||||||
6.29_925.3580m/z | 925.357965370712 | 1 | 6.28863333333333 | 0.165733333333333 | 0 | 2.00437039487023E-4 | Infinity | D0 MA | Blank | 100 - 31.2 - 28.9 | 116.311307964832 | 26.74 | 0 | 0 | 0 | 0 | 209.762033300258 | 176.744829024184 | 108.547905686607 | 16.3355935153932 | 28.1769120257727 | 4.86195843989589 | 5.49176277122846 | 0.00586749531327352 | 55.5874766111158 | 107.679863953297 | 130.373324634291 | 171.604566660624 | 11.1219199481718 | 10.2579535815232 | 12.5664348442106 | 66.2950045036286 | 43.1728891407851 | 27.1586543997808 | 23.8647175349744 | 32.0412385961327 | 0.0370344637760951 | 44.9395988482857 | 0 | 11.5237611479522 | 32.6459654670356 | 6.51511555266656 | 15.3619379103647 | 74.4197099702323 | 123.052801249897 | 45.1197850121601 | 31.5459843966831 | 109.810450533642 | 0 | 0 | 0 | 0 | 249.723900440163 | 205.24771934854 | 123.056030287472 | 16.3355935153932 | 26.7603469238696 | 4.50264815210565 | 5.09704589843477 | 0.00532935811939729 | 58.5709590501898 | 111.522169037793 | 147.190898477511 | 179.806645398381 | 11.437164545072 | 9.99764284442518 | 12.1678161621012 | 74.4784833522697 | 43.2109971113402 | 28.6531247825536 | 22.5948503075067 | 29.3248657605464 | 0.0428024952817837 | 53.7006171503615 | 0 | 12.6377563476602 | 30.1402963040761 | 6.1940228814191 | 15.7976803953974 | 79.8028092432425 | 153.057500857544 | 43.4113136637014 | 32.7433002776891 | 132.461216469431 | x | ||||||||||||
17.18_1322.1593m/z | 1322.15926490561 | 1 | 17.1750833333333 | 0.200016666666667 | 0 | 2.06198152224446E-4 | Infinity | Blank | D6 MA_VO | 100 - 88.2 | 309.390427246962 | 25.87 | 414.767430262987 | 328.121374878507 | 241.670087303132 | 253.00281654322 | 0 | 13.5239981302895 | 0 | 3.98547363280977 | 8.52733579784562 | 0 | 0 | 0 | 0 | 89.4541282979384 | 0 | 69.3352046696802 | 80.128654650834 | 0 | 29.9186537701551 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 129.756938053277 | 0 | 0 | 0 | 256.835554921262 | 220.012116489448 | 174.272280972805 | 170.805715769269 | 0 | 15.7049560546749 | 0 | 3.98547363280977 | 8.09863281249405 | 0 | 0 | 0 | 0 | 92.6460904658829 | 0 | 72.6491771301214 | 82.3998565254443 | 0 | 28.9696070051657 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 161.396347386105 | 0 | 0 | 0 | |||||||||||||
18.23_1574.4069m/z | 1574.40694372607 | 1 | 18.23225 | 0.285733333333333 | 0 | 2.07373277381073E-4 | 296.143401673007 | Blank | D20 MA_VO | 90.5 - 100 - 47.2 - 14.9 - 2.08 | 4798.30717921296 | 10.65 | 5594.02433523916 | 5542.31645351293 | 3682.92550945167 | 4373.96241864807 | 536.129060082362 | 456.822198536331 | 414.011837091247 | 405.062326595826 | 497.948118902078 | 489.710889651968 | 455.95446245276 | 401.741174883779 | 0 | 704.454402538459 | 0 | 880.374669968471 | 364.801661864584 | 13.7925102199677 | 486.590772678277 | 82.4016247957064 | 24.436682111934 | 7.50845977271454 | 42.3242426305204 | 64.7580738897702 | 17.5387884928436 | 89.7613197853517 | 16.4331900126165 | 27.012640344389 | 0 | 46.3772843053739 | 4.37409735598512 | 14.0592087770005 | 880.207947186436 | 72.2205629376809 | 37.5105658282278 | 19.0041751661936 | 3463.97580801658 | 3716.23693714915 | 2655.81825350196 | 2952.92278510046 | 638.267268469128 | 530.49198052939 | 469.347177563814 | 405.062326595826 | 472.914292372407 | 453.520090641635 | 423.183032394171 | 364.895492531478 | 0 | 729.59121673283 | 0 | 922.453400752422 | 375.141760820422 | 13.4425048828156 | 471.155673150348 | 92.5733105608444 | 24.4582519531218 | 7.92163085937386 | 40.072124265192 | 59.2680528885131 | 20.2704139649972 | 107.260375976592 | 16.3352955037258 | 29.6239363690757 | 0 | 44.0916140079805 | 4.49816894531148 | 15.0761721134182 | 1094.83430903543 | 69.4859142128404 | 38.9342651367325 | 22.9241948127783 | x | ||||||||||||
13.03_255.2238m/z | 255.223758636247 | 1 | 13.0260333333333 | 0.674299999999999 | 0 | 2.14951772490646E-4 | 1.52124837475181 | D20 MA_VO | Blank | 100 - 9.04 | 669.462259380233 | 3.64 | 511.117465660818 | 489.328440958963 | 381.022960852471 | 378.828189842806 | 586.65647856517 | 585.368425173764 | 580.09218455665 | 625.112911580764 | 639.842533543799 | 690.875778324137 | 686.922240218677 | 687.754058146938 | 593.796616960854 | 592.631818627383 | 554.004853457368 | 601.454709690097 | 623.329510945052 | 661.341942040551 | 519.133676514843 | 554.681178665399 | 542.027189419463 | 646.012906358488 | 659.787077153682 | 546.151179708028 | 627.747931936917 | 523.777086102418 | 701.559522588572 | 616.216519119071 | 685.809017571775 | 622.99562339375 | 755.558067324525 | 613.486329230882 | 515.861410450981 | 643.1704780782 | 702.714475817979 | 600.93372989793 | 316.498182703763 | 328.104763043023 | 274.76193364172 | 255.752173053865 | 698.420690059191 | 679.768312933908 | 657.625229900093 | 625.112911580764 | 607.675112113715 | 639.818415780687 | 637.55015154579 | 624.676710971062 | 625.666777059649 | 613.778504426816 | 625.468993523265 | 630.202073365037 | 640.997437106141 | 644.559412558599 | 502.666286635659 | 623.151219920154 | 542.505627545462 | 681.561322757554 | 624.679098810495 | 499.849903799758 | 725.518210748951 | 625.887936113404 | 697.38024730065 | 675.785806912006 | 633.171257210719 | 592.291742967699 | 776.989526803367 | 657.862446985244 | 641.646979755703 | 618.816675557312 | 729.385737400108 | 724.889229512866 | |||||||||||||
13.21_607.3283m/z | 607.328273744231 | 1 | 13.2146 | 0.925733333333334 | 15 | 2.35264724660733E-4 | 1.73153632247372 | Blank | D20 VO_MA | 100 - 27.6 - 11.9 - 1.03 | 9933.6995854728 | 5.74 | 8374.6070749082 | 8858.07834883318 | 10944.9175982768 | 11557.195319873 | 4477.0728315429 | 4717.74356507464 | 4861.95474715998 | 6211.01675216981 | 7105.11022488016 | 7364.00699419833 | 7372.63485048669 | 7457.21405456503 | 5869.38148680053 | 6183.0782738971 | 5414.38854473071 | 5621.07538050258 | 6497.38036851158 | 6776.71802751411 | 6717.1533596349 | 5600.70650047083 | 6216.63671773811 | 5953.72648345876 | 6814.04404226708 | 6766.22463885468 | 5393.00050987348 | 5029.73565969661 | 6461.68936476338 | 6168.219262247 | 6951.42886076603 | 6784.42510730805 | 6563.31734704612 | 5678.88991175112 | 4826.35644976511 | 6797.18890616924 | 6085.58565065853 | 5238.58185750981 | 5185.79015224937 | 5939.52334339009 | 7892.56037516388 | 7802.42309499717 | 5330.00215747911 | 5478.55409716302 | 5511.78621861382 | 6211.01675216981 | 6747.90815885766 | 6819.78936974011 | 6842.73152187243 | 6773.275843932 | 6184.40202131053 | 6403.70701744692 | 6112.82037058402 | 5889.74248976974 | 6681.54497900359 | 6604.74878912478 | 6504.07917805998 | 6292.05969559039 | 6222.12403660202 | 6281.34462556858 | 6451.46144714039 | 6192.60171996173 | 6232.94778274918 | 6010.28749590611 | 6423.19629637662 | 6764.49738365795 | 6417.88725200227 | 6450.0597130224 | 6749.48632048862 | 6089.66856390766 | 6003.19577405279 | 6539.81173796861 | 6316.56174742989 | 6319.15197550212 | |||||||||||||
0.86_421.2210m/z | 421.221041796092 | 1 | 0.859966666666667 | 0.102866666666667 | 0 | 2.38881597975582E-4 | 33.8600187467152 | D0 VO | Blank | 100 - 13.4 - 11 | 249.557035044022 | 12.82 | 0 | 13.4747635205356 | 0 | 16.0062638717758 | 50.3911563578696 | 37.295175654895 | 38.8844136528803 | 36.0432319146733 | 34.2989571423607 | 36.2138747694002 | 43.2880979669304 | 53.959236969357 | 37.5263077025206 | 46.7908863933851 | 41.1169302970195 | 34.9180040773874 | 53.2416600729964 | 856.801971836115 | 46.0424317559591 | 42.1420765110186 | 51.8543724486674 | 37.9275139324929 | 49.008523593424 | 88.0159524115639 | 18.8260155491272 | 19.9209453735955 | 47.635421247467 | 75.520549487489 | 33.0577324194843 | 62.825238456386 | 34.3128404559314 | 30.5508409804185 | 30.3252452960229 | 21.4925674272035 | 39.4386695976086 | 60.8800082415084 | 0 | 9.03510550766628 | 0 | 10.8060510739153 | 59.9912001013287 | 43.309610742971 | 44.0815652214817 | 36.0432319146733 | 32.5746125557326 | 33.5375833271247 | 40.1767941159682 | 49.0103668269807 | 39.5404138800147 | 48.4605101660838 | 46.4208297980589 | 36.5869586068696 | 54.7507651327541 | 835.059355137455 | 44.5819241660813 | 47.344109369269 | 51.9001434159979 | 40.014566752929 | 46.4007274656609 | 80.5541889871662 | 21.7581236382428 | 23.8045529599009 | 47.3516512572676 | 82.8210765053822 | 30.5204589911794 | 59.7289428535454 | 35.28612666865 | 32.760715352911 | 37.7196310100675 | 20.6787462699374 | 40.9355493538774 | 73.4378186333786 | |||||||||||||
4.67_557.2541m/z | 557.254125503251 | 1 | 4.67146666666667 | 0.200016666666667 | 4 | 2.43368461660398E-4 | 19.3636934414831 | Blank | D0 MA | 100 - 22.9 - 29.5 | 408.405849806586 | 17.96 | 322.604069266475 | 378.126243569611 | 442.82573543862 | 490.067350951638 | 27.1970573255547 | 29.327493090424 | 37.5402447832636 | 33.189751795127 | 41.6049230993212 | 42.5861665256109 | 38.0040631409486 | 27.0600083377742 | 9.88917987687833 | 40.0240879694796 | 23.5857294722958 | 10.8662816588893 | 60.6903110212506 | 84.3263918346981 | 13.9390241783852 | 17.7738648894822 | 8.49873247086805 | 32.0985207123168 | 0 | 57.556310535491 | 9.30664436784149 | 54.1960973230434 | 12.9507146370187 | 12.4578923717 | 112.426624764316 | 97.564271651112 | 16.7550021592129 | 64.0884968214447 | 56.4871745007408 | 2.89249425368737 | 11.4444195725423 | 17.6341125992937 | 199.765432636252 | 253.541407287953 | 319.328932469616 | 330.85127587955 | 32.3783819644348 | 34.0570137426535 | 42.5577395512878 | 33.189751795127 | 39.5132786325339 | 39.4389475727216 | 35.2725458519938 | 24.5782003131108 | 10.4199504082683 | 41.4522543049623 | 26.6281827360996 | 11.3856506913529 | 62.4105439237346 | 82.186484976975 | 13.4968657208144 | 19.967877069898 | 8.50623415660651 | 33.8648191389341 | 0 | 52.6768362921312 | 10.7561325594486 | 64.7616789641081 | 12.873565656924 | 13.6621894863637 | 103.797566847434 | 92.75588838461 | 17.2302590128848 | 68.7242947946675 | 70.2607796959408 | 2.78296927353345 | 11.8787881796777 | 21.2715273902437 | |||||||||||||
0.86_236.0961m/z | 236.096149246636 | 1 | 0.859966666666667 | 0.17145 | 1 | 2.57007003741649E-4 | 2.28039435779633 | QCs | D6 VO_MA | 100 - 14.6 - 0.875 - 0.484 | 835.764070525208 | 8.25 | 420.92313446528 | 380.875000110686 | 316.79681072075 | 358.683812655167 | 754.750532885461 | 782.28454604935 | 779.502639110397 | 810.060808553394 | 856.74588032358 | 839.5850613549 | 907.328692861142 | 955.854403063442 | 462.801215222514 | 566.279444048286 | 835.382308443104 | 515.706642302391 | 580.091426693287 | 798.593493865247 | 552.055476969822 | 394.742753647662 | 971.909438452502 | 313.798138550328 | 834.949676252317 | 486.605745857474 | 289.009211272344 | 232.171764078808 | 398.653351483518 | 546.164863468275 | 467.286126194821 | 746.996128916504 | 512.463022997931 | 543.659742525765 | 542.017980124045 | 592.902676082589 | 432.30802101333 | 394.038976869418 | 260.647338560408 | 255.384504966488 | 228.447398787775 | 242.152424200188 | 898.538424547286 | 908.440262975203 | 883.688172155754 | 810.060808553394 | 813.673867529716 | 777.537729246015 | 842.115033939379 | 868.188239094779 | 487.640610398844 | 586.485806753722 | 943.142877554696 | 540.355557934771 | 596.533793553087 | 778.32800334829 | 534.54377779586 | 443.469939041445 | 972.767326284423 | 331.065637054837 | 790.521108057293 | 445.352576891436 | 334.021723027115 | 277.433874254437 | 396.278525048044 | 598.962298987923 | 431.42060897287 | 710.180974909428 | 526.999073881056 | 582.985001464909 | 674.181462063303 | 570.452275792814 | 448.716108094612 | 475.317986210269 | x | ||||||||||||
0.86_304.2022n | 304.202189136077 | 325.176856956077 | 1 | 0.859966666666667 | 0.188583333333333 | 0 | 2.72604533823717E-4 | 1.70121654710438 | Blank | D6 VO_MA | 100 - 14.5 - 5.66 - 0.423 - 0.0543 | 4510.4507053602 | 4.7 | 5519.05124181928 | 4751.43113066032 | 3393.39761157762 | 4377.92283738356 | 3835.51651549918 | 3853.19555445795 | 3855.69558285086 | 3899.85914301462 | 4016.7844756067 | 3973.55914555534 | 4193.07122306147 | 4360.03617795956 | 2075.26805049642 | 3293.85260720093 | 2575.88867208035 | 2950.19241378206 | 2971.33925991572 | 3041.04660165023 | 3492.32100342677 | 3593.80920382738 | 4760.60403230333 | 2697.91889659995 | 2812.3222832842 | 3680.51388986073 | 2975.32350088409 | 2803.98454293674 | 2263.91670587177 | 2562.01116348347 | 2532.2044652077 | 3366.05185146591 | 3432.18431914969 | 3093.22913785765 | 3878.53706336289 | 3080.12249618028 | 3082.3931972995 | 2392.74237544557 | 3417.55037861282 | 3185.93209539457 | 2447.0349169673 | 2955.59651880076 | 4566.22263516141 | 4474.58408895353 | 4371.03405562164 | 3899.85914301462 | 3814.84479162692 | 3679.90367774521 | 3891.6969595483 | 3960.15556302355 | 2186.65151602667 | 3411.38606383418 | 2908.16675178832 | 3091.20096000118 | 3055.56020842198 | 2963.87554836618 | 3381.54142169596 | 4037.43028547258 | 4764.80613602856 | 2846.37838309514 | 2662.67559689933 | 3368.48949912378 | 3438.72320869335 | 3350.62404415568 | 2250.43027907815 | 2809.67927297271 | 2337.85068972552 | 3200.15846526153 | 3529.5384767464 | 3316.97577070419 | 4824.26392468803 | 2963.49292817483 | 3199.38426279371 | 2886.29692537665 | x | M-H2O-H, M+Na-2H, M+Cl | ||||||||||
14.23_804.5600n | 804.560002953463 | 785.542161833463 | 1 | 14.2262666666667 | 0.371433333333334 | 0 | 2.78734938352176E-4 | 1.91432640826641 | Blank | D0 MA | 100 - 37.5 - 9.6 | 3744.71212202209 | 9.82 | 3358.23775558145 | 3513.80558972879 | 3974.88428845723 | 4131.92085432091 | 1607.82499605111 | 1641.91668845848 | 1787.65079503501 | 2220.91296747863 | 2258.93264415488 | 2289.17605828707 | 2393.6240119456 | 2296.17750414929 | 2123.09483281381 | 1567.5998853353 | 2510.08149133008 | 1623.82905292903 | 1907.89399923419 | 2018.44871058478 | 1653.83495506116 | 2521.97933302848 | 2012.62550055964 | 2480.99051302253 | 1695.29874195355 | 2461.34002236634 | 2528.39736124769 | 1729.40130755163 | 2792.92665893773 | 2635.58246882956 | 2010.20450877492 | 2728.16667219886 | 2670.16474534101 | 2174.57068156023 | 1892.81447298142 | 2373.84714339646 | 2723.84447627001 | 1852.20651603724 | 2079.51443286039 | 2356.0787681538 | 2866.35453846433 | 2789.51716295889 | 1914.13251922639 | 1906.7016417227 | 2026.58180262241 | 2220.91296747863 | 2145.36714243019 | 2120.00050516917 | 2221.58384488141 | 2085.58363866647 | 2237.04525000044 | 1623.53603522208 | 2833.87074002306 | 1701.44221910498 | 1961.97218694995 | 1967.2275905562 | 1601.37381406247 | 2833.29335560191 | 2014.4020106529 | 2617.51299263707 | 1605.09007679675 | 2252.67401977603 | 2922.18936338788 | 2066.54976671442 | 2776.28885559981 | 2890.36267305416 | 1855.91569002439 | 2593.71098721472 | 2745.90416235795 | 2331.86677771135 | 2354.35073300917 | 2283.9608589423 | 2827.22696095708 | 2234.26392546977 | M-CO2-H, M-H2O-H, M-H | |||||||||||
13.91_755.5645m/z | 755.56453543932 | 1 | 13.90615 | 0.131433333333334 | 10 | 2.83041189106714E-4 | 2.41261704075872 | Blank | D20 VO_MA | 100 - 35.1 | 168.848025822237 | 5.49 | 156.22374534086 | 170.381006218852 | 170.237604074688 | 178.549747654548 | 95.3251129380784 | 78.1996689404637 | 99.4034775052646 | 91.2887988257878 | 93.2375983393517 | 94.0086173084109 | 90.2464569289664 | 90.1929483410873 | 52.8933757750588 | 103.335649628099 | 53.7312292104847 | 83.8596080072792 | 110.057071500801 | 95.5382531629746 | 88.303187403328 | 66.5300805992578 | 99.9108503463457 | 77.7070904319825 | 63.3286295496615 | 174.455081406907 | 75.9049864962806 | 111.315942143887 | 73.0946837462231 | 67.0722708473558 | 181.840192509969 | 224.594994697179 | 71.4432054593281 | 180.504433802918 | 77.4355341064596 | 66.7034853603532 | 56.9902586300705 | 78.8124167012894 | 96.7380980253365 | 114.243961709874 | 122.76114061327 | 120.541414776494 | 113.485546637132 | 90.8105984908043 | 112.689390561656 | 91.2887988257878 | 88.5501745410314 | 87.0611569881679 | 83.7600516081948 | 81.9209042172689 | 55.7322608511386 | 107.022941545072 | 60.6623166662129 | 87.8677945094105 | 113.176577602532 | 93.1138287488588 | 85.5021304110185 | 74.7425773244464 | 99.9990399444687 | 81.9831102771696 | 59.9588452181394 | 159.665233544381 | 87.7270114132991 | 133.01709283123 | 72.6592498370205 | 73.5561077473202 | 167.883449113333 | 213.525995810949 | 73.4696971732767 | 193.561099661577 | 96.3171029632598 | 64.1777420849856 | 59.1533022955457 | 95.0691718175784 | x | x | |||||||||||
13.03_454.3949n | 454.394854015106 | 453.389526769744 | 1 | 13.0260333333333 | 0.13715 | 0 | 3.04185937857304E-4 | 3.00602049855046 | D20 MA_VO | Blank | 100 - 14.2 | 98.4420417806703 | 8.19 | 40.7744562480728 | 56.028621139422 | 27.4697003338157 | 6.72039658091421 | 79.7766753541821 | 75.7926148985053 | 79.7031990162258 | 84.1689495501929 | 92.9044634245191 | 103.030888151317 | 107.798544777858 | 102.749533562061 | 64.6533989662742 | 104.118150327099 | 62.2183428058739 | 90.9087794640604 | 82.026589220554 | 92.9779291288848 | 46.8505466210133 | 68.6053197261058 | 62.9667672467995 | 90.0381505377002 | 106.754823413136 | 68.549432700099 | 90.6701259915636 | 97.865762744439 | 82.2863614895147 | 98.4313866086498 | 98.4443073438948 | 94.3430455928656 | 112.759246355811 | 88.2215678301096 | 54.6383577545466 | 91.2314848901043 | 120.576179899757 | 103.774643203388 | 25.2486799420254 | 37.5683404515599 | 19.8088534176296 | 4.53703308105389 | 94.9749686354251 | 88.0153690338053 | 90.3560433534849 | 84.1689495501929 | 88.2337876394 | 95.4166605657506 | 100.050594573354 | 93.3258625216947 | 68.1234661864825 | 107.833363958532 | 70.2442298305065 | 95.2538909120109 | 84.351586988424 | 90.6184767222193 | 45.3644048965146 | 77.0739847045072 | 63.022346934885 | 94.9927166703771 | 101.074284708759 | 62.7379901641706 | 104.79178700726 | 116.944787936568 | 81.7961716395684 | 107.946690750659 | 90.8884313986856 | 89.6934180800219 | 115.95767057183 | 94.6030151354007 | 67.96115491827 | 87.7769831018073 | 125.152603106261 | 125.180394130071 | M-CO2-H, M-H | |||||||||||
15.37_982.5780m/z | 982.578043590833 | 1 | 15.3693333333333 | 0.120000000000001 | 0 | 3.053135055886E-4 | 10.3789286702294 | Blank | D0 VO | 100 - 24.6 | 117.955283050028 | 20.34 | 145.952218955178 | 183.82288588846 | 81.1833680390539 | 60.8626593174175 | 21.4960207669422 | 21.7566212522212 | 7.38147095484866 | 25.3606758452905 | 20.8761446044944 | 21.9124872679593 | 12.3267003019146 | 23.1989497865954 | 13.806447882046 | 19.2656028037615 | 52.2829261266825 | 41.1251097360612 | 28.5176862844456 | 4.37089722695005 | 3.72746048330688 | 8.8434776179151 | 19.5782691492342 | 16.8136348364136 | 24.6036840555613 | 26.4541223259951 | 23.3869928196365 | 31.1238566941615 | 17.7541259254918 | 26.0126118373707 | 12.6529472603725 | 29.1375067638963 | 25.363419478849 | 35.4939705793305 | 34.6464130607982 | 7.18061940184447 | 3.53503932327324 | 37.1767078150552 | 90.377682557125 | 123.257017920559 | 58.5426640222729 | 41.0892267144258 | 25.5912381540446 | 25.2652194545242 | 8.36805194573202 | 25.3606758452905 | 19.8266180317471 | 20.2931023629293 | 11.4407267452039 | 21.0712586556298 | 14.54746541537 | 19.953050956936 | 59.027188983686 | 43.0907415063462 | 29.3260041431569 | 4.25997924804864 | 3.60922206454363 | 9.93511962890068 | 19.5955505524274 | 17.7388455968546 | 23.2944956266038 | 24.2114106698895 | 27.0294624992987 | 37.1914826880934 | 17.6483624409263 | 28.5272356955585 | 11.681798166838 | 27.7014862045248 | 26.0828547152838 | 38.0614028805081 | 43.0944549242304 | 6.90872354708959 | 3.66921040091382 | 44.8452029618268 | |||||||||||||
1.82_484.2814m/z | 484.281439776701 | 1 | 1.81998333333333 | 0.234283333333333 | 3 | 3.1412119164731E-4 | 1.66382383886143 | D20 MA_VO | Blank | 100 - 24.1 - 28.5 - 1.81 | 248.202517445113 | 8.88 | 158.712606250993 | 130.284156702549 | 133.6910292157 | 174.016045455686 | 171.222893443321 | 179.606214594534 | 167.363753526272 | 203.913760283087 | 228.246710667184 | 227.926391352796 | 231.958462518996 | 215.568455690191 | 149.350267019248 | 183.528048392194 | 178.336880351373 | 175.243368284777 | 226.795961961562 | 164.354354015669 | 225.410648980708 | 211.873353462612 | 198.70331223039 | 211.232133432792 | 214.699204890636 | 265.522473905164 | 215.702873214404 | 183.061080077123 | 243.847621435211 | 185.99995447768 | 242.286196762498 | 267.424922585347 | 267.320968348178 | 215.777982084429 | 158.720697770279 | 206.794234463671 | 211.883638372504 | 204.969686780556 | 98.2792700806506 | 87.3582011284212 | 96.4068034526668 | 117.480649446915 | 203.842650276522 | 208.570548456094 | 189.732993858166 | 203.913760283087 | 216.771843419149 | 211.082089147342 | 215.286599083233 | 195.797599875288 | 157.36617142952 | 190.076819235653 | 201.341537651414 | 183.619368602905 | 233.224366584174 | 160.18361930732 | 218.260419266071 | 238.027075294806 | 198.878704244276 | 222.855690427123 | 203.274829820852 | 243.01216946766 | 249.298093495988 | 218.749014861939 | 242.394991536436 | 203.980460475139 | 223.690053467194 | 254.245082249909 | 274.903547039034 | 231.386136146772 | 197.422513655332 | 198.96392178571 | 219.925601557378 | 247.249090759288 | x | x | |||||||||||
0.84_170.8233m/z | 170.8232619843 | 1 | 0.842816666666667 | 0.0857333333333333 | 0 | 3.14740252254864E-4 | 2.9557977098721 | D0 MA | Blank | 100 | 27.9239197043558 | 7.75 | 8.84542660696202 | 23.3995678713395 | 1.91308552819669 | 3.63059492357883 | 32.655213263285 | 25.563551698136 | 25.2086389161511 | 19.4502527755136 | 15.7150647542692 | 18.2003845902828 | 16.0831017464942 | 17.7844829869995 | 29.189602156759 | 24.5718590952773 | 34.2500021116614 | 23.6842154537254 | 22.0606215798575 | 29.7933492348097 | 20.9071621331282 | 21.934526312116 | 27.6650230497503 | 23.5902877753553 | 25.2690304809085 | 28.4564776521809 | 20.9330408171923 | 19.9404423098249 | 21.0947957615778 | 23.8180811364679 | 19.2314743523702 | 20.020013034578 | 35.6121195798105 | 22.8918393772266 | 24.6071712026552 | 27.1713564687193 | 27.6038120542366 | 18.0617269887595 | 5.47733473111405 | 15.6898905297411 | 1.37955748853896 | 2.45106506347616 | 38.8763738485503 | 29.686077456744 | 28.5779353765511 | 19.4502527755136 | 14.9250061316394 | 16.8553328984861 | 14.9271392822272 | 16.1533795504935 | 30.7562619648215 | 25.4486486422835 | 38.6680986913034 | 24.8162354446483 | 22.6859175530093 | 29.0372989526265 | 20.24396803556 | 24.6421320129398 | 27.6894424922469 | 24.8884001885255 | 23.9244382547252 | 26.0440115217305 | 24.1933131860167 | 23.8278508427234 | 20.969131501039 | 26.1205610049434 | 17.7554049038609 | 19.0333414380857 | 36.6222599392842 | 24.5477050606418 | 30.6072847525306 | 26.142506619079 | 28.6515042781736 | 21.7873464396439 | |||||||||||||
14.88_807.6667m/z | 807.666736832727 | 1 | 14.8836 | 0.9602 | 14 | 3.15811798695664E-4 | 1.88807527467753 | Blank | D0 VO | 100 - 34.9 - 1.24 | 897.395553356287 | 4.55 | 1055.92211160228 | 1068.50698573534 | 695.896988925487 | 769.256127162039 | 609.485981337856 | 644.723605953734 | 589.754212452794 | 516.016508084968 | 598.204071272879 | 570.91066503411 | 489.639159726935 | 554.272613766269 | 543.227376685637 | 443.836162463465 | 766.215977488837 | 604.141938952943 | 422.486234538988 | 442.903322035082 | 491.550629932551 | 544.245778675952 | 571.695513467196 | 359.952589265006 | 588.043591962951 | 449.044547918428 | 607.104991886493 | 477.179655117765 | 516.71984474964 | 630.336316052709 | 490.960676076462 | 453.617294528749 | 698.087599533099 | 526.950950877627 | 536.443246248595 | 575.973960461468 | 524.380400523974 | 523.829677396352 | 653.856406504837 | 716.455864853174 | 501.822782188317 | 519.335496754685 | 725.599452525438 | 748.695452437051 | 668.578649866196 | 516.016508084968 | 568.129980456737 | 528.719009574316 | 454.446663988174 | 503.437514104602 | 572.383392349096 | 459.673421920407 | 865.054400282914 | 633.01774248487 | 434.461370425935 | 431.663995467083 | 475.958199245334 | 611.427670458056 | 572.200139315205 | 379.759847604847 | 556.753161449295 | 410.975719577911 | 701.660180848685 | 570.206290846722 | 513.641681873349 | 691.270556295021 | 453.278070931494 | 431.261100283711 | 717.888905017208 | 565.06759069947 | 667.247407525289 | 554.164569999136 | 544.283059871694 | 631.880808734618 | |||||||||||||
18.30_444.0999m/z | 444.099891763299 | 1 | 18.3008333333333 | 1.78861666666667 | 0 | 3.19672919304348E-4 | 1.47890878540891 | Blank | QCs | 100 | 1039.93733653627 | 4.83 | 1010.7342319203 | 973.473374289927 | 1055.1662135551 | 1120.37552637973 | 575.37549359697 | 608.232676520808 | 607.357752572157 | 674.711729824274 | 744.714632307824 | 791.419619138145 | 814.078849708115 | 809.539816743692 | 809.67387875001 | 831.044200698395 | 770.653683988127 | 746.315636999412 | 838.103047277821 | 894.695734547364 | 894.710143099263 | 727.067161975339 | 837.479492703475 | 769.378441379468 | 901.214487682236 | 898.625169345424 | 767.853018406616 | 706.681946959828 | 882.896057791691 | 763.041031777438 | 943.674652117915 | 881.865700963582 | 765.548063208957 | 831.226471991153 | 571.647818435419 | 835.183994450994 | 817.971885585444 | 722.935981877445 | 625.87481174346 | 652.733877830891 | 760.897738291595 | 756.381080370188 | 684.990559149689 | 706.319785299474 | 688.535016158045 | 674.711729824274 | 707.274874606947 | 732.931827720196 | 755.567462536089 | 735.292891598646 | 853.130569823204 | 860.698076925146 | 870.06455100694 | 781.986830004403 | 861.858609135045 | 871.991507599215 | 866.329127916068 | 816.81659009765 | 838.218721522384 | 811.715343527122 | 853.259897767246 | 822.442065747219 | 887.44433822927 | 844.450276667509 | 877.636538738315 | 836.803758691588 | 871.244983034732 | 838.403599437536 | 787.262889646939 | 891.352675370234 | 711.036120849512 | 803.559554644239 | 849.017698469662 | 872.05706855443 | |||||||||||||
16.20_1086.8104n | 1086.81036294006 | 1067.8118520833 | 1 | 16.1979166666667 | 0.639999999999999 | 11 | 3.38599175069287E-4 | 2.10166905325938 | Blank | D0 MA | 100 - 76.8 - 17.6 - 1.76 | 9125.33532649384 | 4.51 | 7037.0627403307 | 7333.96132241062 | 10641.3272225838 | 11488.9900206502 | 3150.14607133179 | 3408.2429092044 | 3683.98609599273 | 5070.72316316249 | 5794.65181276336 | 5957.89917640138 | 5881.40909129713 | 5742.14948876532 | 4697.61467718894 | 4395.77487311554 | 4557.24241880109 | 3717.15543270592 | 5492.99916596103 | 4572.21642731566 | 4443.23910373866 | 5007.16534909812 | 4864.28966076983 | 4577.49429921043 | 4747.89720002001 | 5095.8107436024 | 6032.02125544622 | 4254.85348844304 | 5663.10271810428 | 6790.65459867393 | 4544.78244906659 | 5489.7536403282 | 6419.08877869447 | 4679.44854004595 | 3559.43051507206 | 5464.56998269408 | 4660.07071663517 | 4509.49905492556 | 4357.54541474627 | 4917.57159494032 | 7673.63635422352 | 7756.3767500901 | 3750.28193382917 | 3957.87581431487 | 4176.37449326707 | 5070.72316316249 | 5503.33168768606 | 5517.59626263483 | 5458.68664299701 | 5215.50838421912 | 4949.7443248968 | 4552.62785867092 | 5145.10624074956 | 3894.82204224221 | 5648.69515333692 | 4456.18967608235 | 4302.29553957054 | 5625.25161416128 | 4868.58328602524 | 4829.38195007786 | 4495.25649539591 | 4663.80116826468 | 6971.49452161122 | 5084.34129519328 | 5629.36692736851 | 7447.10317728248 | 4195.95768398239 | 5219.19517569099 | 6601.16669831596 | 5017.93327808223 | 4427.34772048489 | 5257.65274573109 | 4836.94193439388 | 5439.68017233649 | M-CO2-H, M-H2O-H | |||||||||||
4.18_793.4874m/z | 793.487414425858 | 1 | 4.18003333333333 | 0.468583333333333 | 13 | 3.43469735115343E-4 | Infinity | D0 MA | Blank | 100 - 38.2 | 487.880585555199 | 8.9 | 0 | 0 | 0 | 0 | 155.943073598597 | 148.136900287538 | 154.255896260014 | 170.973854285067 | 124.216078319699 | 146.528978060572 | 156.942606158151 | 144.622829547565 | 0 | 771.349103655885 | 536.573104840245 | 643.600133724667 | 182.527656101728 | 65.4909815920009 | 16.0053547165567 | 1.60065940579318 | 209.303191255751 | 86.8147987949364 | 19.4854178742841 | 70.4262221888642 | 38.2413403041453 | 54.3415697337055 | 0 | 0 | 30.8184344964808 | 101.416284682494 | 0 | 20.2475074425169 | 59.1692153824023 | 633.807361616622 | 509.953281063561 | 374.853059240311 | 0 | 0 | 0 | 0 | 185.651864510322 | 172.02631105671 | 174.873187300337 | 170.973854285067 | 117.971243488898 | 135.700138216009 | 145.662458545915 | 131.358750156294 | 0 | 798.87289941573 | 605.788627557407 | 674.361896509692 | 187.701300368101 | 63.8290511147374 | 15.4976503849063 | 1.79824537006398 | 209.487939601489 | 91.5919922330052 | 18.4485778808585 | 64.4556703235602 | 44.197340019104 | 64.9355113620625 | 0 | 0 | 28.453033447261 | 96.4180577909747 | 0 | 21.7120971679764 | 73.5967986274499 | 609.808095718694 | 529.308364560424 | 452.17456064482 | x | ||||||||||||
14.39_741.6282m/z | 741.628163125691 | 1 | 14.3919833333333 | 0.120000000000001 | 17 | 3.53955356567237E-4 | 2.8819208512941 | Blank | D0 MA | 100 - 36.8 | 106.435457213279 | 9.66 | 125.999234512453 | 101.364411664893 | 101.806210803922 | 96.5719718718504 | 55.8958357312868 | 56.458828667876 | 56.3438601268048 | 50.2742938178861 | 41.7640964422123 | 39.8328295116813 | 54.8916690324883 | 55.8111285397402 | 34.4673878970711 | 40.5193133656366 | 39.4207174198521 | 33.3210758949167 | 47.8647213025855 | 73.1201314375345 | 28.235355642136 | 34.5539415003849 | 59.9475635451333 | 32.1297357258976 | 15.5855025098534 | 77.8112683819529 | 37.6480827224825 | 50.7024880793026 | 29.5991075967313 | 33.0219710628783 | 97.1229923513948 | 132.824136615753 | 45.6180831728999 | 111.836199181711 | 60.2726145329317 | 32.3719012329848 | 35.827757483017 | 49.1087571744496 | 78.0222383786045 | 67.9669185080011 | 73.414135659013 | 65.1970796380572 | 66.5445786235255 | 65.5637049476899 | 63.8745788269282 | 50.2742938178861 | 39.6644497002826 | 36.8890887100532 | 50.9463660677568 | 50.692412205788 | 36.317316204324 | 41.9651506656596 | 44.5058130712881 | 34.9137030227099 | 49.2214200419297 | 71.2646000042969 | 27.3397046166469 | 38.8192922839436 | 60.0004782337699 | 33.8977518338333 | 14.7561811976747 | 71.2146315165866 | 43.5116839503804 | 60.5869872160921 | 29.4227821176513 | 36.2141855470773 | 89.6685310276831 | 126.277996875433 | 46.9120434167292 | 119.925794837917 | 74.9692461842138 | 31.1461315238255 | 37.1875864386085 | 59.238493995948 | x | ||||||||||||
18.46_446.0973m/z | 446.097272003226 | 1 | 18.4551166666667 | 1.78861666666667 | 0 | 3.54732874213726E-4 | 1.50310459509019 | Blank | QCs | 100 | 789.560804274471 | 3.01 | 725.24851054284 | 756.1558076034 | 801.694238621684 | 875.144660329959 | 435.493493077667 | 405.960085774668 | 412.148289610979 | 561.3045063618 | 563.057420216358 | 648.352689320563 | 587.583686041406 | 588.393172873021 | 622.685051592643 | 598.695725435366 | 617.336963781616 | 582.784332774581 | 608.979934357923 | 708.01185138654 | 692.327560447369 | 588.095841278785 | 671.711174223014 | 623.170916781318 | 709.688440874478 | 665.673617941592 | 592.065204007263 | 562.196630293614 | 695.044931480222 | 585.84616710457 | 764.513445253169 | 659.368988789556 | 638.221200126827 | 628.442857587555 | 482.019173479531 | 650.107769412882 | 623.252207886001 | 554.184093021866 | 449.094094835226 | 507.017988962807 | 578.114921736722 | 590.822316334874 | 518.459570574407 | 471.427550168311 | 467.234554996631 | 561.3045063618 | 534.750290921404 | 600.43788415116 | 545.351491257987 | 534.428706939914 | 656.105707282724 | 620.058787622221 | 696.970661884119 | 610.639319839127 | 626.241129800937 | 690.045003959921 | 670.366303881373 | 660.690600327565 | 672.304082183502 | 657.462397678197 | 671.925157422311 | 609.239540722081 | 684.277981024442 | 671.797407639128 | 690.904464402799 | 642.479570864226 | 705.834899925015 | 626.872473841095 | 656.324390841859 | 673.900845681854 | 599.552787980583 | 625.491284712147 | 646.907509207093 | 668.496475089091 | x | ||||||||||||
0.86_151.0663m/z | 151.066310740293 | 1 | 0.859966666666667 | 0.0514333333333333 | 0 | 3.55180306959246E-4 | 8476.45484092804 | D0 MA | Blank | 100 | 8.02824914167476 | 25 | 0 | 0 | 0.00378849379479301 | 0 | 0 | 4.3758028689635 | 1.30059262047385 | 1.39648434519835 | 2.41857307052954 | 0 | 0.0470894574741138 | 0 | 8.65963556438247 | 9.28063565569532 | 10.8904534412462 | 3.28227190537506 | 6.28902622729238 | 4.72095535008044 | 0.943226425563661 | 2.00368999701074 | 9.5486764779548 | 2.93759922179927 | 3.74771698282553 | 13.1615801463115 | 2.67906324345806 | 8.87045576295497 | 0 | 11.2575641534735 | 4.90781236014576 | 0 | 8.15385557359416 | 4.16340960018748 | 4.66039905372685 | 8.39703443196484 | 8.56124894580836 | 7.20553389302134 | 0 | 0 | 0.00273194528308236 | 0 | 0 | 5.08147007260204 | 1.474425175542 | 1.39648434519835 | 2.29698181152355 | 0 | 0.0437049333841237 | 0 | 9.12441418378017 | 9.61179351806688 | 12.2952730655678 | 3.43915265237673 | 6.46728515625034 | 4.60115412879204 | 0.913306430008023 | 2.25102620028189 | 9.55710493130374 | 3.09924769557162 | 3.54829694077644 | 12.0457756284691 | 3.09632110595675 | 10.5997597015451 | 0 | 12.3458262465838 | 4.53112403396266 | 0 | 8.3851402794019 | 4.46456701132194 | 5.79677199476103 | 8.07907873392314 | 8.88618790460466 | 8.69183015043647 | x | ||||||||||||
16.54_987.8025m/z | 987.802471746732 | 1 | 16.5350666666667 | 0.200000000000003 | 0 | 3.67184894172201E-4 | 3.05734898732878 | Blank | D6 MA_VO | 100 - 62.3 - 37 | 319.335506594144 | 21.84 | 396.240423445492 | 400.116490122433 | 208.48897186408 | 272.49614094457 | 149.645059932928 | 199.59164795196 | 169.828999016019 | 118.465798988193 | 127.782594886038 | 170.827003150182 | 140.460651059191 | 93.6465534826845 | 71.241681775286 | 88.4280556841665 | 151.825062841997 | 170.871968778494 | 118.213966415442 | 100.513650332609 | 143.074024158684 | 170.823566911367 | 106.838933332368 | 61.220537750849 | 104.117606081132 | 145.616910918312 | 180.259094682513 | 200.95540255087 | 109.016825762276 | 167.561607595303 | 94.3550886997798 | 122.850675717469 | 121.509275613057 | 168.250563717402 | 142.066644699869 | 130.775302534089 | 87.5494184000749 | 150.124613620034 | 245.363115838993 | 268.286318947556 | 150.344832038952 | 183.965929843511 | 178.15401319342 | 231.778948042384 | 192.527735237407 | 118.465798988193 | 121.358457124575 | 158.202481484063 | 130.365133236186 | 85.0577620449907 | 75.0653542904756 | 91.5834048413194 | 171.409814651918 | 179.039031982404 | 121.56467513878 | 97.962967859877 | 138.535586673329 | 191.910088545016 | 106.933238230803 | 64.589345319121 | 98.5773965407903 | 133.271888111727 | 208.334028981596 | 240.131852825667 | 108.367399289958 | 183.75968946458 | 87.1130717233765 | 116.79607065148 | 124.955895044738 | 180.420854190087 | 176.707603338668 | 125.823464722688 | 90.8723233918834 | 181.09104229584 | |||||||||||||
3.59_537.2754m/z | 537.275448979583 | 1 | 3.59143333333333 | 0.188566666666667 | 4 | 3.68680018523748E-4 | 1.70911211785706 | Blank | D20 VO_MA | 100 - 9.63 | 183.558392701229 | 5.61 | 157.027142852029 | 191.515886771755 | 193.56125007323 | 192.129291107904 | 88.1716643161001 | 93.8544622349483 | 87.7800134132968 | 129.148682726852 | 109.791091618199 | 125.326818577366 | 143.829605842241 | 132.794856101595 | 103.940730304245 | 112.643974273108 | 107.957418178766 | 118.36528398303 | 128.42197573314 | 127.205555224934 | 116.298909500297 | 100.033717044248 | 114.755487649837 | 104.518062303758 | 143.817875543185 | 134.997056117174 | 100.639813212176 | 88.6941856538745 | 125.725733736296 | 128.730713351832 | 136.405361186441 | 135.141113534757 | 109.838889483425 | 119.946003108195 | 93.117507681151 | 125.522854277388 | 117.044962512282 | 93.9140933400623 | 97.2355841598494 | 128.415332910295 | 139.580205952001 | 129.709153187715 | 104.969291033709 | 108.989974025045 | 99.5123758574189 | 129.148682726852 | 104.271458070565 | 116.064868725768 | 133.491946588162 | 120.615579015161 | 109.519421089882 | 116.663412069529 | 121.883440677906 | 124.022717220024 | 132.062024767999 | 123.977526205265 | 112.609802875347 | 112.381914524764 | 114.856780355315 | 110.269420463057 | 136.165172065397 | 123.552356967339 | 116.314229800034 | 105.985203013077 | 124.976770269702 | 141.175035555994 | 125.935868178727 | 128.480783293574 | 112.954477564564 | 128.622215933943 | 115.822905833865 | 120.769901663543 | 121.48735970127 | 113.28589389256 | |||||||||||||
16.95_987.8028m/z | 987.8027845925 | 1 | 16.9522333333333 | 1.8229 | 8 | 3.89242053693839E-4 | 2.11997544756547 | Blank | D6 MA_VO | 100 - 69.7 - 23.1 | 2260.8367677652 | 10.72 | 3102.28975689854 | 2812.78410967254 | 1534.80848614381 | 1593.46471834592 | 1480.81354697236 | 1538.18451583636 | 1439.33362230763 | 1274.4250211911 | 1257.94548281584 | 1254.12208195861 | 1167.61558442881 | 1178.82424539607 | 1002.90120399114 | 1046.38701253512 | 967.873681962787 | 1509.85669699778 | 1189.13721433791 | 991.410400219392 | 1364.31485954309 | 1321.27696052929 | 1173.0500505718 | 830.09951630281 | 1076.86017618011 | 1185.76941087179 | 1208.21661373488 | 1443.43340464325 | 979.64462923204 | 871.237966242645 | 1131.64197586279 | 1171.7077351433 | 865.308093577054 | 1340.12885161407 | 1350.98670174803 | 980.338850934725 | 946.815105337307 | 1187.67873053288 | 1921.02429724142 | 1886.02947743372 | 1106.775682177 | 1075.77016528453 | 1762.9240571159 | 1786.24102077381 | 1631.70980315208 | 1274.4250211911 | 1194.70357506443 | 1161.43947848446 | 1083.69397468167 | 1070.70840761165 | 1056.72876215081 | 1083.72489532032 | 1092.72504371933 | 1582.0223960377 | 1222.84264321528 | 966.251895650547 | 1321.03755790301 | 1484.37585675301 | 1174.08548178051 | 875.777741873461 | 1019.55929070798 | 1085.24296563787 | 1396.39353823021 | 1724.83214428485 | 973.808767187451 | 955.460027055675 | 1044.78528892262 | 1113.96098244841 | 889.852620525035 | 1437.06616364807 | 1680.40585960658 | 943.218088099719 | 982.751113792188 | 1432.66299934775 | |||||||||||||
16.82_1035.9508n | 1035.95083324925 | 1034.98340690311 | 1 | 16.8207833333333 | 0.120000000000001 | 0 | 3.92744655016375E-4 | 3.3449914422836 | Blank | D6 MA_VO | 100 - 45.8 - 1.43 | 232.404730061948 | 7.75 | 339.056357399048 | 318.864644051939 | 120.185515625212 | 151.512403171592 | 97.720491712496 | 106.68649409942 | 92.2791039324707 | 87.1443773896163 | 48.1671916699376 | 95.1993419434372 | 51.6813281628049 | 57.785542948704 | 110.372797320329 | 73.6516096420354 | 111.234758495058 | 81.2273727250313 | 84.3942432898309 | 78.8580132214078 | 95.4266787251629 | 99.777978038632 | 73.9014435701559 | 61.9608915531221 | 72.7609979576783 | 69.2903585645887 | 89.119528424415 | 83.0901720507782 | 72.635304246164 | 105.008680519691 | 61.3608252819374 | 71.5080403516715 | 90.3213391539114 | 84.8668310258067 | 95.8961111981347 | 79.7997168042314 | 35.1621682097574 | 101.824609778893 | 209.953148073732 | 213.805288477465 | 86.6677551269577 | 102.288127955385 | 116.337270188662 | 123.891373343665 | 104.612798713959 | 87.1443773896163 | 45.7456359397035 | 88.1638842417728 | 47.9667663574187 | 52.4857432439334 | 116.296709011093 | 76.27969574671 | 125.583543188329 | 85.1097478839016 | 86.7863508873118 | 76.8568745552391 | 92.3996581435036 | 112.09460700567 | 73.9666751099393 | 65.3704388728554 | 68.8893071820012 | 63.4161022617879 | 102.999687479288 | 99.2886815327394 | 72.2026069164398 | 115.15980778836 | 56.6512103104351 | 67.983819252816 | 92.8833105018004 | 91.0056157184699 | 119.279032844902 | 76.7780816227162 | 36.4967349767585 | 122.828124393362 | M-CO2-H, M-H | |||||||||||
2.90_443.2178m/z | 443.21776753218 | 1 | 2.9 | 0.41715 | 3 | 4.15702652267536E-4 | 1.92740789156531 | D0 MA | Blank | 100 - 17.2 | 561.056077035609 | 6.62 | 259.785149817845 | 262.463736384389 | 302.461368068786 | 339.664094284664 | 343.817977120345 | 365.419138730357 | 422.5067470458 | 504.46291479337 | 557.469558125131 | 564.973546784807 | 601.58654711998 | 610.337538653005 | 763.536448395065 | 613.79469065737 | 471.307807326134 | 395.585361763868 | 534.87756076153 | 548.156696861033 | 585.050631843064 | 492.086985334439 | 538.414237815269 | 467.648888551879 | 534.351311740778 | 536.194933894979 | 471.420899365056 | 497.157583314988 | 690.287213065016 | 543.748786569704 | 568.236149734786 | 617.291158939502 | 474.165283408508 | 496.385559137342 | 381.631520136087 | 509.72447133132 | 578.441102638649 | 458.858431454046 | 160.866206566566 | 175.98732226768 | 218.109874944458 | 229.311948135967 | 409.318907416568 | 424.348736224985 | 478.977486781156 | 504.46291479337 | 529.443352815936 | 523.220658478861 | 558.34790581559 | 554.360445731424 | 804.516858448867 | 635.696524242267 | 532.104399534144 | 414.492913863623 | 550.038365894004 | 534.246410304255 | 566.492296505813 | 552.83037718315 | 538.889486850704 | 493.382395197297 | 505.917905070888 | 490.737722600186 | 544.843606830659 | 594.078935486882 | 686.175088294068 | 596.312661359259 | 524.62243584089 | 586.868418842405 | 487.615016125449 | 532.291272067341 | 474.687013438015 | 490.423633469546 | 600.395615444682 | 553.507846678371 | |||||||||||||
17.80_457.1349n | 457.134894695876 | 492.105282657561 | 1 | 17.79795 | 2.76578333333333 | 0 | 4.28816654325259E-4 | 1.89745647678782 | Blank | D6 VO_MA | 100 - 11.4 | 6105.31402743708 | 5.21 | 8590.45116799815 | 7428.49522841322 | 3966.16640018906 | 4436.1433131479 | 4206.98409909498 | 4221.13215980761 | 3843.71840755151 | 3344.87179074306 | 3276.84604221487 | 3315.27648848044 | 3210.49443941273 | 3091.04117521762 | 3559.98184282064 | 3255.39311174587 | 3523.6851858558 | 4282.77840068965 | 3024.79902720458 | 3002.05223794947 | 3582.12256452854 | 3579.94371241512 | 3419.2745004763 | 2835.15730198124 | 3631.26109810647 | 3438.49243394601 | 3202.40171620572 | 3633.77728634249 | 3224.36043417654 | 2809.98297498861 | 3801.10514911608 | 3288.07935256427 | 2654.22198498848 | 3521.14284562247 | 3606.8235330825 | 3209.96776685686 | 3541.81792249301 | 3555.7488017739 | 5319.4468315843 | 4980.95851920683 | 2860.06792562485 | 2994.9019706974 | 5008.4586890513 | 4901.85627298178 | 4357.45605393591 | 3344.87179074306 | 3112.10599747664 | 3070.2696740648 | 2979.74224234304 | 2807.54640694324 | 3751.05263716128 | 3371.5542308825 | 3978.22476271801 | 4487.47974601163 | 3110.53526289757 | 2925.87072429211 | 3468.49439603612 | 4021.85323288693 | 3422.29263557398 | 2991.16866233594 | 3438.03779864333 | 3146.98599249193 | 3701.16832734453 | 4342.18568622139 | 3205.1525274373 | 3081.62237337676 | 3509.35969692769 | 3126.02878353693 | 2729.50918444962 | 3775.84232644573 | 4486.29686118786 | 3088.42157691662 | 3676.24627929771 | 4289.19842741558 | M-H, M+Cl | |||||||||||
1.27_250.1355m/z | 250.135521234404 | 1 | 1.26568333333333 | 0.10285 | 0 | 4.3608999425826E-4 | 3.89597229954133 | D6 VO_MA | Blank | 100 | 29.5269613038048 | 6.05 | 10.0506899608372 | 11.9789943630007 | 8.28568656037601 | 0 | 22.15713155424 | 21.5624421023268 | 22.8127463692086 | 21.056687765129 | 24.3780611472223 | 25.4373614661067 | 27.6665511708395 | 30.476130546702 | 29.2772009841802 | 19.743149701297 | 32.6518707416954 | 33.4501328757749 | 39.1257491588101 | 23.3010576989514 | 29.894976346137 | 23.252973938738 | 31.6246450853849 | 20.0595148545356 | 24.0963387867166 | 36.0273788164533 | 31.3009722061536 | 27.6823571032709 | 30.7886746307392 | 28.3358412750556 | 23.2660034947875 | 26.8295537388842 | 17.8828743234779 | 26.8052375673647 | 27.0426371525453 | 27.8049265953461 | 21.4319652260481 | 26.5061670348821 | 6.22366739788716 | 8.03216158714074 | 5.9749450683619 | 0 | 26.3782974794601 | 25.0397258551873 | 25.8618164062479 | 21.056687765129 | 23.1524793431683 | 23.5574799776078 | 25.6780358226615 | 27.6810129544465 | 30.8485623829467 | 20.4476380029739 | 36.863815546034 | 35.0489284613152 | 40.2347466232283 | 22.7097589124466 | 28.9466806504584 | 26.1233292818053 | 31.6525596185032 | 21.1633379822063 | 22.8141467439084 | 32.9730713850857 | 36.1760257491271 | 33.0790594201987 | 30.6052627563521 | 31.0750503540036 | 21.4802726496984 | 25.5072789444073 | 18.3901233530409 | 28.7441762560463 | 33.6366049136929 | 26.7520864627669 | 22.2454073429159 | 31.9736337690989 | |||||||||||||
16.87_1280.1102m/z | 1280.11022137404 | 1 | 16.8722166666667 | 0.21715 | 0 | 4.37044395037334E-4 | 131.057174912958 | Blank | D6 MA_VO | 100 - 82.9 - 33.6 - 2.81 | 1388.31568806206 | 14.02 | 1573.02747090189 | 1563.64150081236 | 1151.01197353207 | 1265.5818070019 | 84.6863111978282 | 93.4243306973947 | 88.733456335026 | 82.5891467898786 | 81.6434304791803 | 73.1271845397647 | 99.6704953039319 | 113.736157267396 | 12.8938981923474 | 418.368579487199 | 11.7983750609289 | 380.334493705467 | 542.771129344512 | 5.71534790237206 | 352.591511120703 | 8.94295363429677 | 10.4679343187574 | 12.6780444957583 | 4.6043789442384 | 14.6224673531592 | 10.8898661950258 | 14.8055172113972 | 3.91394079087834 | 23.2878407741131 | 10.6959437168873 | 24.1347770931378 | 9.70990192200838 | 0 | 531.639803133388 | 0 | 11.3655019208492 | 14.0347239842628 | 974.062459868919 | 1048.453719761 | 830.013694673103 | 854.411857397628 | 100.819941595146 | 108.490476995399 | 100.593252547868 | 82.5891467898786 | 77.538891475379 | 67.7229117457678 | 92.5067433621551 | 103.304848293755 | 13.5859374999994 | 433.2970875772 | 13.3203125000006 | 398.513109372652 | 558.155673261084 | 5.57031249999727 | 341.406989398485 | 10.0468749999955 | 10.4771741852739 | 13.3756844351855 | 4.35937500000307 | 13.3828126192076 | 12.5859374999973 | 17.6918671251703 | 3.89062497019737 | 25.539062619208 | 9.87500011921009 | 22.945312380785 | 9.98532399555191 | 0 | 661.272712181036 | 0 | 11.7968752384264 | 16.9296874999944 | |||||||||||||
13.04_491.2483m/z | 491.248267905034 | 1 | 13.0431666666667 | 0.417150000000001 | 1 | 4.40155019974076E-4 | 1.46511561148398 | Blank | D6 VO_MA | 100 - 13.7 | 255.330703441883 | 3.08 | 262.883923815681 | 250.101456217884 | 264.265877843461 | 244.071555890505 | 167.970496752456 | 151.304801457748 | 179.877605962461 | 200.977570130042 | 215.750443123028 | 219.408670946125 | 209.921262902596 | 224.023322776776 | 183.794291658777 | 181.217616918987 | 172.304213645162 | 184.27760348583 | 173.623282142488 | 198.657014267286 | 205.540413848058 | 150.447417839872 | 191.021129931561 | 172.175952228744 | 203.913247670418 | 187.743182485416 | 168.633831107302 | 177.250079742259 | 165.15216020523 | 186.057595658006 | 224.28503397047 | 209.383269130513 | 197.880795353969 | 185.297931305727 | 167.886029127737 | 212.678495486733 | 206.477532533152 | 183.13449639838 | 162.78505380779 | 167.698159682416 | 190.566477750694 | 164.776097643463 | 199.970637907826 | 175.705086237274 | 203.919403026175 | 200.977570130042 | 204.903812797865 | 203.193848529211 | 194.833308838026 | 203.477029027005 | 193.65887042716 | 187.683945397913 | 194.530684010967 | 193.085407630024 | 178.544536912038 | 193.615798843309 | 199.020485968426 | 169.018700411515 | 191.189741014575 | 181.650348767095 | 193.06280495792 | 171.826803989628 | 194.898157671677 | 211.80515438609 | 164.168328727403 | 204.043673794401 | 207.07053027014 | 199.063968934506 | 203.49369849229 | 198.701331556832 | 208.822682508496 | 204.625373871139 | 214.314309019952 | 220.909922986011 | |||||||||||||
13.36_640.5659n | 640.56590519797 | 685.565075577751 | 1 | 13.3631833333333 | 0.251433333333333 | 0 | 4.47485937564829E-4 | 2.43634805599997 | Blank | D0 MA | 100 - 35 - 10.6 - 1.61 | 5077.52345251997 | 2.9 | 6075.05281782615 | 5609.19102973593 | 4228.42392315168 | 4397.4260393661 | 2728.11942772562 | 2672.9466185056 | 2661.36153980472 | 2671.63207597536 | 2786.9844686167 | 2873.30669697544 | 2800.79801625044 | 2820.87074935 | 1755.22749917372 | 2600.75130461859 | 1933.54561141382 | 2046.76142870785 | 3105.97960990113 | 3051.8545857396 | 1788.74097532799 | 2083.84464376943 | 2968.38994880016 | 2347.90048865006 | 1630.37169260439 | 4607.94343963686 | 2035.48885524604 | 2959.671406781 | 1907.15927723262 | 2156.35940250582 | 4778.29500472375 | 6912.07118070704 | 1871.88205633463 | 5581.99536728563 | 2952.81955254056 | 1678.29319371887 | 1825.08448555732 | 1953.10743095481 | 3761.84205363724 | 3761.07771309557 | 3049.18614558745 | 2968.76340136727 | 3247.85478877883 | 3104.00140370499 | 3017.06959868622 | 2671.63207597536 | 2646.87170770885 | 2660.96250091482 | 2599.49248278985 | 2562.15465529388 | 1849.43379777943 | 2693.55305598019 | 2182.96431873298 | 2144.5892355218 | 3194.01686378051 | 2974.40926388118 | 1732.00049331698 | 2341.07516504058 | 2971.01009581873 | 2477.09936906343 | 1543.61786541179 | 4217.29398487895 | 2352.51150521662 | 3536.66221282883 | 1895.79809777338 | 2364.81339529476 | 4411.54749783965 | 6571.41484371276 | 1924.97812687434 | 5985.7652182512 | 3672.82318325549 | 1614.74422434748 | 1894.35487545091 | 2355.97782308069 | x | M+Cl, M+FA-H | ||||||||||
13.75_751.6111m/z | 751.611141528787 | 1 | 13.7518666666667 | 0.302983333333334 | 14 | 4.59602253030211E-4 | 1.77381950223746 | Blank | D20 MA_VO | 100 - 30.2 | 191.858162600628 | 8.5 | 231.266860092844 | 221.288209727581 | 143.699379523545 | 171.178201058543 | 127.954581249187 | 116.980930792646 | 112.945305742209 | 106.37169081321 | 142.640758900642 | 126.172792247004 | 136.45820075422 | 134.938976232797 | 131.107068820769 | 113.991607668535 | 144.410253955326 | 138.623291698957 | 94.8869514458061 | 151.332868683405 | 139.116645799316 | 153.750930805421 | 119.455042381502 | 85.0149006153066 | 130.361588584623 | 121.399705978444 | 102.246836555685 | 118.103737421089 | 110.379735202468 | 135.394662429441 | 122.769511730716 | 101.266373767784 | 105.951706841511 | 102.656568711602 | 125.530936329424 | 129.785902541736 | 107.724057472395 | 129.582552140432 | 143.20688658987 | 148.37828652386 | 103.623989726677 | 115.56478127549 | 152.331270850126 | 135.845950260727 | 128.04117109701 | 106.37169081321 | 135.469642314736 | 116.848322929956 | 126.650356440379 | 122.563051219244 | 138.143827121595 | 118.059132623104 | 163.038528691929 | 145.248984566738 | 97.5764689840559 | 147.492573415829 | 134.70373993576 | 172.730000188186 | 119.560483303532 | 89.6930503201377 | 123.424908574828 | 111.107754792518 | 118.171543287658 | 141.128175369075 | 109.722189713075 | 148.483184664153 | 113.346608309285 | 96.2755351252773 | 108.957034704568 | 110.082162020447 | 156.139894417115 | 124.871528595436 | 111.812683243467 | 156.31173905872 | |||||||||||||
15.14_736.4908m/z | 736.490773782799 | 2 | 15.1350333333333 | 0.285733333333333 | 408 | 4.6914194223846E-4 | 65.254584759623 | D6 VO_MA | Blank | 100 - 74.1 - 88.1 - 23.3 - 2.39 | 241.399970421971 | 19.28 | 0.0456425763361408 | 8.98914616210059 | 5.76263714734344 | 0 | 95.3602922807134 | 93.6383004077342 | 112.404876751529 | 98.1034137656374 | 96.8917744204008 | 59.9790200865014 | 71.940686066927 | 109.080090318159 | 156.671832972218 | 34.5445251731822 | 508.279791131104 | 155.639666996934 | 22.0875218503153 | 23.3333617200293 | 9.87235787766772 | 84.113900093846 | 143.676716490639 | 59.6693316065637 | 141.05352226921 | 87.9504146117983 | 376.610991666062 | 4.68428869814725 | 88.864093630213 | 495.440507693459 | 4.37179766935745 | 26.6436042543486 | 735.569567504662 | 27.8808246934542 | 92.3529057345161 | 129.677495751751 | 67.4032947570617 | 94.8410349114861 | 0.0282631556048071 | 6.02740700232966 | 4.1555325745651 | 0 | 113.527428013468 | 108.738952695081 | 127.428510301533 | 98.1034137656374 | 92.0206407000035 | 55.5464279047552 | 66.7699961056383 | 99.0758124146404 | 165.080699336853 | 35.7771660759604 | 573.845603342627 | 163.078681169277 | 22.7135802965794 | 22.7412431712326 | 9.5591977542679 | 94.496949728559 | 143.803537469972 | 62.952780319935 | 133.54791299535 | 80.4942073115328 | 435.267276753702 | 5.59749531477107 | 88.3347194309691 | 543.334449630071 | 4.03624996996812 | 25.3304938432543 | 756.434051733741 | 29.8975652477817 | 114.87186642709 | 124.767226654236 | 69.9615612619182 | 114.40403708886 | |||||||||||||
13.36_755.5305m/z | 755.530468920264 | 1 | 13.3631833333333 | 0.217149999999998 | 23 | 4.9167509026582E-4 | 2.24793764544757 | D20 MA_VO | D20 VO_MA | 100 - 38.6 - 9.96 - 0.393 | 1584.66964990189 | 4.84 | 1463.8503195921 | 1442.96306824408 | 1554.88641569697 | 1596.88184137918 | 759.283194101604 | 810.048823862533 | 822.210007946039 | 961.082774300666 | 1037.82453722064 | 1068.54126297523 | 1033.01585559649 | 1069.22102458836 | 653.284048236887 | 929.720332818273 | 674.42761755087 | 711.95199220641 | 1147.13596155755 | 1164.2521279431 | 707.422640403502 | 703.649769042765 | 1063.04081695149 | 913.679148311966 | 610.042460366529 | 1577.89744656842 | 726.346637256324 | 930.097289908716 | 726.267449048805 | 769.646862142697 | 1606.46279089957 | 2250.32582311692 | 730.537479404084 | 1751.35250618699 | 909.109670223451 | 593.042279914494 | 657.498606171421 | 660.124543967288 | 906.456924343642 | 967.536353820405 | 1121.25420792045 | 1078.07711250963 | 903.934605259592 | 940.681968330754 | 932.103655068064 | 961.082774300666 | 985.64898228471 | 989.573523233797 | 958.768513704088 | 971.157443607935 | 688.347008537772 | 962.895236934946 | 761.425753802169 | 745.980727054295 | 1179.65088842953 | 1134.70750901065 | 684.982554244782 | 790.508545883145 | 1063.97914489195 | 963.956544474873 | 577.581446459789 | 1444.12740680108 | 839.473434854235 | 1111.42065701554 | 721.94098564192 | 844.048170785722 | 1483.16227829371 | 2139.4201724219 | 751.259228088556 | 1878.03540251393 | 1130.7833118504 | 570.586593492552 | 682.453716559137 | 796.289421364742 | x | x | |||||||||||
2.80_636.3385m/z | 636.338455419058 | 1 | 2.79715 | 0.131433333333333 | 4 | 4.93603214431926E-4 | 2.86282226530927 | D0 MA | Blank | 100 - 24.9 | 98.2961691421138 | 7.38 | 56.1151075321933 | 57.6229035724258 | 11.701870004144 | 11.9017489787685 | 112.961410463999 | 104.297230967843 | 98.7347543538595 | 70.0250379097059 | 58.7750989069305 | 62.4803214658965 | 71.8225848483535 | 47.4570449357202 | 98.9243563736576 | 87.7059386686798 | 98.4507245267653 | 108.103656999352 | 63.8982904577394 | 59.2195252634374 | 84.9017759485724 | 87.9844468514895 | 81.194899969573 | 77.3369089051522 | 96.6925774573313 | 69.6591533575253 | 83.6827078760608 | 76.999083498087 | 72.8995514733667 | 70.9811166392461 | 64.4312327659814 | 63.7618218593138 | 66.6339158299785 | 39.5575075460693 | 106.99564470971 | 75.3258890335763 | 79.0540442751449 | 102.411003099875 | 34.7480388548322 | 38.637339545255 | 8.43841122427146 | 8.0350360561201 | 134.481743795422 | 121.116803861846 | 111.931288267072 | 70.0250379097059 | 55.8202416146798 | 57.8628771654844 | 66.660383335239 | 43.1045231819161 | 104.233809114286 | 90.8355207624437 | 111.150426204941 | 113.270621514357 | 65.7094517421065 | 57.7167422619929 | 82.208614804864 | 98.8452781495572 | 81.2665693185289 | 81.5925586200688 | 91.5474616573014 | 63.7536315917982 | 96.7160947890911 | 92.0101293698401 | 72.4652799908144 | 77.8428193585952 | 59.4859554319046 | 60.6193674333087 | 68.5239916941456 | 42.4188730391425 | 133.085031917741 | 72.4736564004563 | 82.0545105620152 | 123.535473942055 | x | x | |||||||||||
13.38_824.5944m/z | 824.594409351766 | 1 | 13.3803166666667 | 0.171433333333333 | 16 | 5.3053438828099E-4 | 3.99655869145599 | D6 VO_MA | Blank | 100 - 27 - 1.78 | 111.140874089256 | 9.26 | 38.0097781177277 | 34.4197659216226 | 12.5816644042362 | 26.225365488739 | 77.9733339604396 | 86.5701696132594 | 62.8262521344588 | 82.8020739093724 | 78.288038729499 | 84.8704984830364 | 81.4089586480773 | 78.1751693726832 | 66.996492122707 | 18.4692043341278 | 54.8819726675115 | 56.4856135277689 | 46.1059359681061 | 75.8510166797815 | 192.240090692058 | 68.2979838579459 | 71.0395282721955 | 132.150978491897 | 33.0684457287504 | 67.641807348361 | 102.548068526887 | 104.911914611899 | 98.5895811007671 | 138.51393211747 | 56.4506930458758 | 75.3764229944921 | 50.2237752243892 | 76.7606968577226 | 102.354627122392 | 66.6390246341046 | 62.4103530699985 | 73.4828098634597 | 23.5367141752447 | 23.0791595100792 | 9.07284545898443 | 17.7051085233651 | 92.8280717943464 | 100.530974370438 | 71.2233841510235 | 82.8020739093724 | 74.3521885746201 | 78.5983668694445 | 75.5577427610204 | 71.005335562702 | 70.5923174760689 | 19.1282348632748 | 61.9615008653734 | 59.1854219228541 | 47.412782921393 | 73.9261849962853 | 186.142061095735 | 76.7287111878723 | 71.1022336483128 | 139.422904431357 | 31.308838248264 | 61.9073109280752 | 118.519691437015 | 125.364593932059 | 98.0022709913973 | 151.90399231487 | 52.117944457522 | 71.6615515063764 | 51.6483762579106 | 82.3131298303296 | 127.312367288122 | 64.1157221794073 | 64.7791143655807 | 88.6402190028694 | |||||||||||||
16.31_669.4607m/z | 669.460652090811 | 1 | 16.3122166666667 | 0.199999999999999 | 11 | 5.33243760085123E-4 | 3.15082711567387 | Blank | D20 VO_MA | 100 - 15.7 | 169.026983792446 | 15.68 | 208.369297376024 | 209.762136909627 | 107.270687180468 | 150.705813703666 | 67.9044576287411 | 54.3813356714963 | 80.6517021738967 | 53.1517953029801 | 68.0948552684962 | 75.6461143103251 | 55.1052769390508 | 53.0127876587302 | 42.4995406071979 | 62.8701809169949 | 71.1707940239668 | 74.3880725636275 | 73.1886502829734 | 39.9264250309079 | 63.2440818683288 | 71.1475701401409 | 60.600319991966 | 23.9108413706197 | 76.4293074233995 | 62.248691283376 | 97.0698764627227 | 80.1303833239892 | 66.1820609673624 | 86.8092456749702 | 24.6886365347611 | 69.1335217916245 | 83.460502101709 | 49.2119272629629 | 59.0765484145737 | 58.2460773202802 | 27.810149392605 | 69.4483206763918 | 129.028077460643 | 140.649818128808 | 77.3546595901697 | 101.743588201705 | 80.8409689281085 | 63.1511834508876 | 91.4313200486898 | 53.1517953029801 | 64.6714568668451 | 70.0556866176444 | 51.1446210451425 | 48.1507210924922 | 44.7805693712367 | 65.1135568550007 | 80.351507082686 | 77.9435538668935 | 75.2631416175307 | 38.9132329700464 | 61.2379223745573 | 79.9300514105387 | 60.6538108575496 | 25.2265930175737 | 72.3624219648646 | 56.9714092099743 | 112.188283713746 | 95.7518791282535 | 65.7878063916651 | 95.2010443013564 | 22.7937146246362 | 65.7263270910283 | 85.8278653081008 | 52.7716386617126 | 73.4815361192922 | 56.040575803928 | 28.8656730720124 | 83.7735296945685 | |||||||||||||
12.89_460.1011m/z | 460.101051372741 | 1 | 12.8946 | 0.234283333333332 | 0 | 5.50040982332467E-4 | 2.07196603460551 | Blank | D6 VO_MA | 100 - 3.17 | 119.363396368141 | 11.55 | 85.237438699512 | 114.277460893408 | 121.345853708393 | 156.592832171252 | 57.0238978957025 | 41.385774653876 | 58.8602254157338 | 67.1565383655825 | 74.2923405079841 | 71.4100732193038 | 86.8634491960292 | 88.4612526854368 | 48.8402130015683 | 70.1647407902659 | 54.0710698741295 | 61.808325764933 | 65.1170316217626 | 69.8430836696031 | 75.63230218634 | 53.4961013682486 | 56.5081867197203 | 47.7036505952192 | 54.2240218361419 | 75.3105247368738 | 42.8456862071863 | 50.4313877601643 | 76.0593639855468 | 61.0986065884912 | 67.1003760941592 | 72.624624234551 | 81.2134030523367 | 57.3707634603903 | 51.5344883869614 | 68.2273078671635 | 61.2309950089322 | 63.8503460149245 | 52.7813981309366 | 76.6253830537808 | 87.5044940329273 | 105.71799614246 | 67.8875484603673 | 48.0598833248942 | 66.7272724947619 | 67.1565383655825 | 70.5573699474751 | 66.132699034242 | 80.6201953529539 | 80.3480309877175 | 51.4615573527468 | 72.6684061032878 | 61.0459952504738 | 64.7625405882224 | 66.962737442394 | 68.070712168139 | 73.2331771364607 | 60.0996790783589 | 56.558065529281 | 50.3286588859566 | 51.3387034505252 | 68.9258944107015 | 49.5188020762331 | 60.2630356272821 | 75.6062691160667 | 67.0049728845786 | 61.9502345438384 | 69.0453731214574 | 83.5170271309179 | 61.5206387447632 | 64.1004505412433 | 65.6438646915787 | 63.5549942163149 | 77.0208524236941 | |||||||||||||
13.06_1260.8971m/z | 1260.89713639357 | 1 | 13.0603166666667 | 0.102866666666667 | 0 | 5.50678860732789E-4 | 3.3467306582012 | D20 VO_MA | Blank | 100 - 73.1 - 88.2 - 66.2 | 241.143766678039 | 9.58 | 140.702418449837 | 131.387689186829 | 6.82907786968979 | 9.29494500589745 | 278.683187945516 | 242.662205290845 | 269.721301706638 | 221.760573268941 | 209.554742181787 | 193.223262650779 | 190.219364934543 | 196.896825564971 | 194.758664620344 | 158.470485392515 | 196.79663748364 | 163.358118348496 | 177.263193032745 | 174.692556469093 | 72.1663667449086 | 242.553361279685 | 134.199885137405 | 200.526961175658 | 127.090718618409 | 129.407708739078 | 268.733291397474 | 225.134818057116 | 231.268852308147 | 209.179560161248 | 194.853346890562 | 323.472897934775 | 195.765080117517 | 237.585022973516 | 223.908685522611 | 224.150729340251 | 243.620875680104 | 272.894776169192 | 87.1268597402023 | 88.0981423089406 | 4.92456054687045 | 6.27514648437557 | 331.775257828642 | 281.795311823342 | 305.771285609276 | 221.760573268941 | 199.019594311733 | 178.943604161492 | 176.547471956003 | 178.838437865372 | 205.211721516906 | 164.125135476679 | 222.182520617804 | 171.16604662931 | 182.287619039518 | 170.259474589885 | 69.8771843028626 | 272.494234148778 | 134.318341079851 | 211.561440278086 | 120.328085109241 | 118.436859916251 | 310.58787584021 | 269.025068793258 | 229.891155664887 | 229.400824981378 | 179.897807496387 | 307.53077441687 | 201.317970839427 | 254.770574555999 | 278.505677873931 | 215.663208871997 | 252.867413677728 | 329.185189969236 | x | x | |||||||||||
2.04_217.9789m/z | 217.978943928894 | 1 | 2.04283333333333 | 0.251433333333333 | 0 | 5.56808617380722E-4 | 1.75391563874678 | D0 VO | Blank | 100 - 3.51 | 79.2820403066262 | 1.39 | 30.8900388159175 | 23.7399236598094 | 60.3497402449049 | 65.8318222014568 | 63.1237844429459 | 77.2344050579432 | 61.8499360461809 | 78.814324102278 | 81.7881965435441 | 75.8804371737936 | 89.5239883890115 | 67.847538149691 | 55.0193795101469 | 64.5948042102384 | 49.8010743345785 | 62.0272807054627 | 78.6161976524631 | 78.8591477996487 | 80.9300539073953 | 78.7227618669975 | 65.9710678458129 | 85.2288408900669 | 72.3584564202144 | 69.957030148402 | 75.8701942742173 | 74.1307902198545 | 78.2911406192479 | 74.5851129683281 | 82.9293780098496 | 78.275977905807 | 79.7420783943404 | 71.0863063834938 | 57.8125848935661 | 66.5375812064902 | 84.1875000162364 | 76.2377944933805 | 19.1279731289293 | 15.9181060716527 | 43.5191918286676 | 44.4439776013094 | 75.1495273650036 | 89.6896705884114 | 70.116577148444 | 78.814324102278 | 77.6763795756235 | 70.2726924644109 | 83.0895100240576 | 61.6249027930527 | 57.9723711295659 | 66.8997193126262 | 56.2251894474118 | 64.9919607844104 | 80.8445297798534 | 76.8579803418798 | 78.3628793800491 | 88.4403274885508 | 66.0292993786334 | 89.9187631738928 | 68.5081853116827 | 64.0262551634317 | 87.6868003836563 | 88.5826595401846 | 77.8247507852878 | 81.7952118891271 | 76.5643162875209 | 74.4182039895799 | 82.0039682420904 | 76.2282861677073 | 71.9093728224352 | 64.0181199312117 | 87.3828046700431 | 91.9634784345579 | x | x | |||||||||||
13.04_236.0954m/z | 236.095361665067 | 1 | 13.0431666666667 | 0.171433333333333 | 0 | 5.67891753295413E-4 | 1.95210485722726 | D20 MA_VO | Blank | 100 - 6.14 | 45.4711830314146 | 7.53 | 38.1424304898257 | 30.68529272556 | 11.4808622635053 | 12.8650631866855 | 46.1206953745365 | 43.1719912653331 | 43.8769007644791 | 37.7924747477942 | 40.6186558789855 | 41.2903154629465 | 35.2080044486698 | 49.3635254540872 | 41.8228231538979 | 41.194205767302 | 48.8114593651493 | 39.7414278015417 | 28.7484681306128 | 40.6411468730256 | 41.6680901440777 | 35.2801622980255 | 41.0291953578972 | 45.2240830394511 | 37.6230675744358 | 41.3576411416029 | 34.9779937634322 | 43.1786327715798 | 39.6766551136952 | 43.8189327435916 | 44.8731029129337 | 48.7486115093993 | 38.6916248627016 | 49.571392840624 | 38.6039723457231 | 47.697733186465 | 50.1293156644068 | 38.7078993917328 | 23.6188562218798 | 20.5751185827149 | 8.27903890184816 | 8.685382858745 | 54.9071715159031 | 50.1341555273012 | 49.7413302932136 | 37.7924747477942 | 38.5765949763659 | 38.2388629844143 | 32.6774520573515 | 44.836150884634 | 44.0675312435471 | 42.6641250303884 | 55.1079185877043 | 41.640924570901 | 29.5633273716039 | 39.6098176888029 | 40.3463406275947 | 39.6351580341931 | 41.0654111266288 | 47.7126471522247 | 35.6211037783188 | 37.8514479398665 | 40.425734852733 | 51.5963490321878 | 39.4402964600314 | 48.0548831512727 | 41.4289667507246 | 46.3460720973775 | 39.7891156132827 | 53.157105938259 | 48.0170095308179 | 45.8916472196648 | 52.0319548401007 | 46.6922357160756 | |||||||||||||
16.06_937.8204m/z | 937.820416190437 | 1 | 16.0607833333333 | 0.120000000000001 | 0 | 5.80017003936062E-4 | 14.1565664155153 | Blank | D0 VO | 100 - 49.7 - 9.1 | 271.393509429713 | 18.76 | 326.284868640836 | 301.067185935633 | 216.741121753855 | 241.480861388528 | 38.2542226347434 | 43.7498142803809 | 31.412859075444 | 23.6071473360116 | 36.7059171989242 | 31.3133695136938 | 15.7719665218322 | 20.1917947643821 | 39.9360273754924 | 14.2422855031736 | 39.6007021392122 | 25.3701029523476 | 27.641920161816 | 5.83229886012164 | 0 | 43.2092087144016 | 25.7867782469835 | 6.25067647881584 | 24.6634102236191 | 29.8544039149101 | 90.1962193644983 | 38.4399606306337 | 25.2373170993749 | 86.4887545228822 | 5.96880358208811 | 69.9640079403288 | 71.463643894899 | 32.6196656119181 | 22.9112717519171 | 12.6655899647797 | 23.727954748534 | 50.1975803859179 | 202.044686215224 | 201.871727520789 | 156.295593261695 | 163.027083799287 | 45.5420532226636 | 50.8051616137618 | 35.6113893985599 | 23.6071473360116 | 34.860565185553 | 28.9992370605401 | 14.6383666992179 | 18.3399047851522 | 42.0794676542212 | 14.7504882812476 | 44.7090150117859 | 26.5827022790992 | 28.4254149198762 | 5.68429565429813 | 0 | 48.5429687499933 | 25.8095397949295 | 6.59463500976426 | 23.3510437011716 | 27.3234252333659 | 104.244070526427 | 45.933868169795 | 25.0869753360735 | 94.8495714584479 | 5.51068121194402 | 66.5158833415956 | 73.4907153465577 | 34.9791870117137 | 28.497864007947 | 12.1860044002581 | 24.6285402774865 | 60.5519104004009 | |||||||||||||
2.04_174.8186m/z | 174.818550784406 | 1 | 2.04283333333333 | 1.83433333333333 | 0 | 5.9085508849599E-4 | 80.0570987208615 | Blank | D0 MA | 100 | 1128.34127822185 | 32.39 | 1459.12877095925 | 1428.51842400499 | 780.176867305305 | 845.541050617843 | 275.253606528633 | 219.632014778924 | 234.426904363611 | 169.094632431967 | 121.890576247134 | 108.480026744273 | 108.918278503017 | 104.939152377196 | 16.5783059699436 | 4.05216984436414 | 20.5968217218235 | 15.1495283169306 | 348.637358342159 | 12.4039815674546 | 0 | 162.965974359968 | 22.9992209550655 | 188.449282449668 | 3.40545085836905 | 74.431149704688 | 128.613115306035 | 286.141619525321 | 63.4537543378629 | 39.4288413211497 | 127.550807005371 | 402.745262839244 | 83.0216996530896 | 478.228133773456 | 45.5882257605423 | 4.39211562913518 | 37.8018446699413 | 67.7387996200031 | 903.533209811775 | 957.850923384312 | 562.598390825966 | 570.836508211002 | 327.692305185467 | 255.051139986284 | 265.759565429607 | 169.094632431967 | 115.762653627203 | 100.463094861611 | 101.089848166219 | 95.3146604989894 | 17.4680942414448 | 4.19676208496165 | 23.2537192981802 | 15.873621075727 | 358.519289160495 | 12.0892121976077 | 0 | 183.082551984606 | 23.0195219738851 | 198.819158185415 | 3.2242431640623 | 68.1210705055752 | 148.644308564699 | 341.925205269157 | 63.0757526161393 | 43.2404041779184 | 117.760925797947 | 382.896259205781 | 85.3766161961428 | 512.820441648327 | 56.7042751775144 | 4.22580713033642 | 39.2365993564808 | 81.7113831720026 | x | ||||||||||||
2.81_379.1756m/z | 379.175578689127 | 1 | 2.81428333333333 | 0.131433333333333 | 0 | 5.94760932794092E-4 | 2.39712797577612 | D6 MA_VO | Blank | 100 - 3.47 | 50.7248383902067 | 14.44 | 21.3279653063745 | 19.3106588817335 | 18.6004308627608 | 25.4036322028788 | 20.8603514391092 | 28.5756448122287 | 27.2854537052872 | 39.6273647127788 | 42.730916156462 | 45.7172814937783 | 40.5263492224325 | 43.6396629896989 | 40.9671080007927 | 51.2667320949349 | 37.2919252485304 | 48.1739717362246 | 41.5214289796424 | 50.7946177955756 | 48.4032424907531 | 35.5514866954128 | 57.2580612501685 | 41.6378299460833 | 58.1298010098085 | 45.8736613547666 | 37.6643068173159 | 31.1571439823567 | 46.4473035347006 | 42.7065838957466 | 41.4116651547642 | 41.5400253060352 | 53.6331173502912 | 20.9305400295585 | 34.6423234436346 | 52.3886562388317 | 50.6325264775234 | 42.8842655941258 | 13.2068706584094 | 12.9481931280736 | 13.4130770990468 | 17.1503449678424 | 24.8344671529293 | 33.1839180755967 | 30.9323297978608 | 39.6273647127788 | 40.5826635536137 | 42.3386657006601 | 37.6135442639537 | 39.6372523307837 | 43.1658882792192 | 53.0960659941614 | 42.1024162625645 | 50.4765136614197 | 42.6983306479157 | 49.5056292761895 | 46.8678478485426 | 39.9399748113422 | 57.3086019611468 | 43.9290518432128 | 55.0366519233635 | 41.9846117102247 | 43.5304349102095 | 37.2312593653481 | 46.1706113060256 | 46.8350041957666 | 38.2332040224116 | 39.4927557554986 | 55.1544246209382 | 22.444536454187 | 43.0893681112837 | 50.404947359364 | 52.5542648288989 | 51.7300672239367 | |||||||||||||
16.31_987.8034m/z | 987.803433251798 | 1 | 16.3122166666667 | 0.199999999999999 | 0 | 6.19623067447006E-4 | 6.29918563040647 | Blank | D6 MA_VO | 100 - 60.1 - 29.7 | 217.379314369043 | 23.78 | 331.056462207486 | 255.860389217198 | 137.191757008883 | 145.408649042604 | 71.2359616672798 | 73.6303842779272 | 76.9762956104241 | 65.6791857995887 | 42.1277882692203 | 55.7738708004094 | 45.0490254680977 | 45.5213654690313 | 37.5088066210072 | 34.5390611456684 | 72.6209143842145 | 67.4116214053521 | 58.2748901406776 | 9.37500731413537 | 60.3307010817531 | 75.945509190531 | 47.6835761713636 | 10.8353969261806 | 35.044246345933 | 44.4732361388077 | 77.8317035039955 | 84.5973030449194 | 37.3998019745832 | 62.6422833569125 | 41.6885232583724 | 30.2832031076713 | 60.6229555845406 | 66.9625059190921 | 55.3704927833416 | 29.0111176463137 | 17.5845600233217 | 52.7529814981498 | 204.99938996516 | 171.559642459541 | 98.9312359316344 | 98.1673987590629 | 84.8071594238173 | 85.5044446348884 | 87.2646717975549 | 65.6791857995887 | 40.0098572969421 | 51.6520491484539 | 41.8111560997541 | 41.346374511731 | 39.5219734831637 | 35.7715070773542 | 81.9886864621651 | 70.6336535305232 | 59.9266592900158 | 9.13710264388636 | 58.4169566622667 | 85.3202497575366 | 47.7256656481826 | 11.4316407442062 | 33.1795043945235 | 40.702910900112 | 89.9538101089854 | 101.089629173261 | 37.1770068116171 | 68.6978759765798 | 38.4888124921737 | 28.7907177478695 | 62.3425301245867 | 71.806193392158 | 68.8718108046815 | 27.9126048038404 | 18.2519753339893 | 63.6344179235793 | |||||||||||||
6.66_163.0184m/z | 163.018432075047 | 1 | 6.66006666666667 | 0.18285 | 0 | 6.24970248183754E-4 | 6.697869085607 | D6 VO_MA | Blank | 100 | 41.0775939162078 | 40.39 | 0 | 0 | 0 | 24.5317389105016 | 12.300713150391 | 28.3881106773417 | 6.82594235572524 | 15.5590745210703 | 24.9672464881618 | 78.6572252796194 | 65.7222227615583 | 33.6031883064781 | 7.25673476300271 | 34.4235761272653 | 24.5403052186731 | 21.755109274835 | 19.5076666255243 | 45.0268389119391 | 64.0479823562259 | 35.6155807068939 | 9.24071446747838 | 29.1049864722414 | 42.0720180825929 | 59.839451966968 | 59.8455865643848 | 15.918692136491 | 61.6564091663503 | 26.889687797605 | 36.1041812414131 | 11.4845727921984 | 27.2935129026144 | 32.2536255438566 | 7.58138573305643 | 79.8266719580852 | 30.7677111514797 | 14.0035175496207 | 0 | 0 | 0 | 16.5617176951754 | 14.6441280043955 | 32.9661411047056 | 7.73827338218555 | 15.5590745210703 | 23.712044000629 | 72.8442693275305 | 60.9984808007071 | 30.5212726857473 | 7.64621710777436 | 35.6519012451137 | 27.7058944702158 | 22.7949249551112 | 20.0606005191761 | 43.8842163085893 | 62.0163224116896 | 40.0119806103132 | 9.24887108802992 | 30.7065584659599 | 39.8333208561029 | 54.7664189338736 | 69.1663973331531 | 19.02205657959 | 61.2891144481201 | 29.4890980720449 | 33.3330843448653 | 10.9185640811981 | 28.0676953792558 | 34.5866696834605 | 9.43000030517089 | 76.8040161132836 | 31.9354879664504 | 16.892044067386 | |||||||||||||
13.06_1264.9627m/z | 1264.96267133507 | 1 | 13.0603166666667 | 0.0857166666666664 | 0 | 6.50936681671599E-4 | 5.12833774655571 | D20 MA_VO | Blank | 100 - 45.7 - 5.29 | 92.8277521514198 | 11.88 | 29.0904387486518 | 43.3133355259772 | 0 | 0 | 60.6028456256854 | 76.778782308039 | 62.30717554931 | 77.4370201868655 | 57.3199327405286 | 53.6865909145338 | 53.9788941016027 | 53.63884569675 | 42.3504629167759 | 41.5244609025796 | 52.8892477933175 | 31.6807803991059 | 61.756025220417 | 58.1721277856935 | 16.2499601499757 | 63.7376513022478 | 30.2313705634271 | 62.5409748245861 | 15.6432458276593 | 47.382705103191 | 76.8967334780948 | 73.7297480596885 | 65.80777761747 | 58.7198782853429 | 70.1288276302048 | 120.846499981376 | 75.7810132039298 | 104.554667790168 | 73.0047428418117 | 92.8770508910643 | 97.2014504344755 | 89.2818288380447 | 18.0136106014294 | 29.0424804687482 | 0 | 0 | 72.1483232657081 | 89.1605714865173 | 70.6349296471843 | 77.4370201868655 | 54.4382324218635 | 49.7190242085561 | 50.0991962406042 | 48.7193602323628 | 44.6234904060933 | 43.0061645507765 | 59.7117234245214 | 33.1950073242026 | 63.5064651954832 | 56.6959240436792 | 15.7344967126828 | 71.6054495654708 | 30.2580552769638 | 65.9824426237358 | 14.8108519315801 | 43.3657226562503 | 88.8732206784438 | 88.1034338226402 | 65.4157526931486 | 64.3962943180488 | 64.7462439536724 | 114.890669240347 | 77.9305471497411 | 112.117558809177 | 90.8059253963938 | 89.3602393563029 | 100.890694643772 | 107.698125260671 | x | x | |||||||||||
3.68_584.2831m/z | 584.283132954667 | 1 | 3.67715 | 0.371433333333333 | 15 | 6.90166625179622E-4 | 1.41262008111806 | Blank | D6 VO_MA | 100 - 39 - 0.794 | 290.420846323733 | 4.61 | 327.469948491693 | 349.731714516447 | 260.953072321963 | 223.52864996483 | 281.535084516609 | 238.959144274779 | 288.263555066548 | 243.218980756907 | 264.10830375332 | 278.580607252261 | 267.736390881868 | 281.559943879083 | 248.731696437511 | 247.954219836043 | 249.302781583822 | 280.591096269367 | 197.424673414322 | 200.645812593264 | 203.063803163925 | 240.57193874738 | 283.862589187016 | 200.285133521923 | 273.354433754077 | 275.046718106081 | 200.189908739717 | 222.204047415746 | 215.15301173148 | 184.813835858315 | 245.763157888492 | 221.023818932104 | 240.009790945764 | 231.038399282553 | 247.570774767039 | 231.703191497604 | 241.732777978217 | 216.454147094614 | 202.778520694291 | 234.5022927651 | 188.177559117472 | 150.907296502997 | 335.170470604663 | 277.495073834189 | 326.79183019392 | 243.218980756907 | 250.830532013195 | 257.992838063774 | 248.493012144603 | 255.736680285796 | 262.081585542101 | 256.801888514483 | 281.461721691907 | 294.002337645399 | 203.020565299776 | 195.554128471603 | 196.622435615783 | 270.268224116936 | 284.113149837593 | 211.306305475148 | 258.808951017959 | 251.728973027691 | 231.369020923243 | 265.522941578035 | 213.871319107975 | 202.679680467769 | 226.900148101431 | 210.130822813075 | 246.817686105158 | 247.75040527818 | 307.937435688737 | 222.929695260567 | 250.907653943205 | 261.102467885985 | x | x | |||||||||||
17.96_1518.3446m/z | 1518.34455720313 | 1 | 17.9636833333333 | 0.199999999999999 | 0 | 7.33654647945836E-4 | 331.155545955694 | Blank | D6 VO_MA | 94.4 - 100 - 47.9 - 8.85 | 1093.81187350741 | 10.98 | 1264.32371214011 | 1251.14003623906 | 849.996571600722 | 1009.78717404975 | 89.7101694549677 | 84.4613426003772 | 83.7832438971316 | 65.9431712537826 | 82.5174135878901 | 78.0888148403125 | 96.8024932473391 | 89.8476989866814 | 0 | 337.475501882643 | 0 | 289.827005742491 | 182.549708411125 | 0 | 177.93153446019 | 11.2652923479961 | 0 | 12.9649764612624 | 0 | 15.1821864733333 | 0 | 5.55793829289529 | 0 | 7.65412337257659 | 0 | 9.81213614898115 | 0 | 10.1549977376273 | 348.005356274141 | 26.4409201757267 | 9.92797043568167 | 1.15912532502891 | 782.904486983757 | 838.915073727102 | 612.946529729672 | 681.721347591126 | 106.800897535994 | 98.0820657529454 | 94.9814124314341 | 65.9431712537826 | 78.3689359874705 | 72.3178657710579 | 89.8448770856573 | 81.6073193992363 | 0 | 349.517528954102 | 0 | 303.679690246685 | 187.723977737867 | 0 | 172.287385212489 | 12.6558840274723 | 0 | 13.6784055233023 | 0 | 13.8950802087851 | 0 | 6.64146374380662 | 0 | 8.39404296875273 | 0 | 9.32855224609386 | 0 | 10.8895526151014 | 432.861581169442 | 25.4397284693625 | 10.3047827906022 | 1.39821984016735 | x | ||||||||||||
3.34_566.2820m/z | 566.281993284594 | 1 | 3.34 | 0.657166666666666 | 6 | 7.91775726262767E-4 | 1.54747556325091 | Blank | D20 VO_MA | 100 - 29.7 | 516.599410747886 | 6.97 | 494.904748184802 | 466.908434026937 | 583.547287762595 | 521.037173017212 | 256.106881851771 | 292.645463196517 | 320.988422165107 | 337.46281192316 | 390.309146765239 | 435.734952518651 | 423.883929610543 | 412.199627740295 | 361.081983207612 | 408.954596744237 | 337.473094123674 | 344.56424647725 | 378.730655288993 | 366.843298713252 | 352.301587099422 | 307.993611783851 | 371.247732716464 | 347.181270270322 | 387.409233019889 | 410.40981780206 | 324.078006312939 | 316.750817394955 | 373.874238863613 | 360.877332514355 | 421.933531260655 | 376.006252645632 | 358.387579700925 | 383.238492089165 | 287.969312006689 | 363.979637457477 | 369.317365702309 | 314.06827237977 | 306.458816095122 | 313.071688228407 | 420.805561949094 | 351.759432940535 | 304.897928663975 | 339.83915812645 | 363.890585912526 | 337.46281192316 | 370.686758202735 | 403.533103587771 | 393.417548214766 | 374.394748631625 | 380.461919510576 | 423.547188791715 | 381.005608895734 | 361.03317346922 | 389.465563768525 | 357.534107681278 | 341.126262029453 | 346.012452364995 | 371.575426738073 | 366.285756016737 | 366.794772031219 | 375.616341351684 | 374.552401244515 | 378.501695896634 | 371.647024611702 | 395.763131598785 | 389.54895255472 | 357.475061434707 | 368.553269439742 | 410.95978862445 | 358.186589591737 | 350.197462257598 | 383.334666336401 | 378.851604849136 | |||||||||||||
0.86_262.0656m/z | 262.06563243729 | 1 | 0.859966666666667 | 0.188583333333333 | 2 | 8.72568180097399E-4 | 118.524093003752 | D0 MA | Blank | 100 - 18.8 | 166.574179145013 | 20.03 | 5.62161413510213 | 0 | 0 | 0 | 12.1501277921631 | 6.30989009878782 | 16.2439839026949 | 4.29472351074548 | 6.29704623490011 | 6.0107030481625 | 0 | 8.34373683765063 | 614.746689845952 | 35.2993483376857 | 8.79197812711599 | 7.45870026929953 | 8.86865508437959 | 9.9804256482774 | 8.70203653732 | 13.0928865921253 | 25.5160829391717 | 9.39071977514384 | 8.55322114325047 | 7.34400487171509 | 16.7929740516367 | 6.63580129262634 | 7.54928937921971 | 13.254192085647 | 14.6471848562319 | 26.800127659589 | 17.322698782367 | 18.9443817450823 | 7.95909781004443 | 17.6022600602825 | 48.3592322665356 | 57.9688790944975 | 3.48106018118803 | 0 | 0 | 0 | 14.464854556221 | 7.32745936198747 | 18.4150966568658 | 4.29472351074548 | 5.9804687499979 | 5.56649780273403 | 0 | 7.57849121093534 | 647.741279013317 | 36.5589233465853 | 9.92610385257025 | 7.81519921382422 | 9.12003214968398 | 9.72715759277219 | 8.42600006562549 | 14.7090771527346 | 25.5386055490011 | 9.90746675274757 | 8.09809506840043 | 6.72139924808768 | 19.408440661054 | 7.92945717882825 | 7.50431734544626 | 14.5354670244322 | 13.522972449174 | 25.4793031077561 | 17.8140583920038 | 20.3147107565817 | 9.89981217422449 | 16.935746313087 | 50.1946885977722 | 69.9262065214281 | |||||||||||||
16.04_669.4603m/z | 669.460257839707 | 1 | 16.0436333333333 | 0.120000000000001 | 0 | 8.79826735470934E-4 | 4.54059369627791 | Blank | D0 VO | 100 - 25.1 | 101.924934657662 | 16.83 | 123.780509877738 | 110.91619013926 | 86.1247325838599 | 86.8783060297914 | 40.7832798422725 | 42.0051407264507 | 30.9107695392832 | 31.4284277772864 | 29.3129773452676 | 44.7569189475473 | 41.1452112898969 | 44.2693251323798 | 39.1180657411799 | 13.1814452678894 | 45.4052974416748 | 40.6864124906777 | 28.2522283365582 | 9.60474734714408 | 18.4154189622538 | 33.5175680553655 | 35.4566864372537 | 11.1095850670513 | 28.3665832417143 | 32.5755237117136 | 48.8892696265853 | 43.026476648984 | 23.1640335155336 | 47.7340896060644 | 12.4543828399557 | 31.9614400684761 | 60.5595684023052 | 43.7424028456007 | 37.167098813053 | 28.1070325388688 | 25.9072062717117 | 43.4342191666466 | 76.6483422353776 | 74.3715820236348 | 62.1059633943683 | 58.6527511787803 | 48.5529223507124 | 48.7791319418957 | 35.0421923718829 | 31.4284277772864 | 27.8392977347339 | 41.4492762298131 | 38.1879260233392 | 40.2091650249417 | 41.217604509702 | 13.6517944335959 | 51.2623770608433 | 42.6310761164739 | 29.0530219382918 | 9.36101268391858 | 17.8312652123453 | 37.6549885336153 | 35.4879834477069 | 11.7209167480397 | 26.8571669093778 | 29.8138555742598 | 56.5036595419125 | 51.4145299261877 | 23.0260425543635 | 52.3485159206047 | 11.4984741210887 | 30.3862440361813 | 62.2773449603215 | 46.9064799033057 | 46.2297745412444 | 27.0427530931687 | 26.8905044662319 | 52.393460542731 | |||||||||||||
13.36_767.4326n | 767.432614914319 | 802.403755947715 | 1 | 13.3631833333333 | 0.171433333333333 | 0 | 0.00100290442294448 | 2.43984367674214 | Blank | D0 MA | 100 - 42.1 - 29.1 | 1169.36673890582 | 11.24 | 1580.70383867369 | 1419.81039219801 | 806.921104964498 | 870.031619787094 | 756.766932469156 | 709.046355930675 | 712.174769021265 | 627.839727291456 | 565.446662450495 | 583.292816605452 | 575.312649310987 | 625.593373594072 | 409.971583944038 | 538.585515231057 | 471.451415916204 | 497.108962643588 | 671.89353417354 | 616.683639453899 | 365.804719839092 | 515.108932665674 | 624.378620230887 | 516.008542251241 | 356.212891320082 | 867.971720788446 | 506.142092778599 | 705.157408176161 | 416.980610791139 | 483.557266516148 | 963.515449128945 | 1187.46644453357 | 436.218812846473 | 1016.78413407021 | 691.417402170827 | 378.29292483611 | 432.702688373083 | 525.084849645378 | 978.815880780492 | 952.012009326914 | 581.884101158416 | 587.370431641992 | 900.938969397866 | 823.391259991268 | 807.361499904707 | 627.839727291456 | 537.019416473991 | 540.186090706542 | 533.962427301327 | 568.217092131709 | 431.97551532904 | 557.803684604913 | 532.266532987906 | 520.868976331984 | 690.937980395721 | 601.034380421212 | 354.201063182339 | 578.694161851154 | 624.929748555827 | 544.403155338495 | 337.258421147704 | 794.387336797393 | 584.972545276916 | 842.628527572041 | 414.496606645929 | 530.30246253044 | 889.562943378877 | 1128.9430354536 | 448.592191168715 | 1090.33252514982 | 860.009837653097 | 363.968773618791 | 449.125754904415 | 633.394887241505 | M-H, M+Cl | |||||||||||
13.91_668.5960n | 668.595993777084 | 713.597506316675 | 1 | 13.90615 | 0.217266666666667 | 0 | 0.0010723200780669 | 2.66438438955314 | Blank | D0 MA | 100 - 37.7 - 11.2 - 2.08 - 0.0965 | 5803.0196730278 | 1.84 | 6974.7128679083 | 6523.30283222948 | 4698.92239653635 | 5015.14059543707 | 2987.19452455683 | 2947.25810505204 | 2972.61758743702 | 2944.0988639599 | 3071.29036900801 | 3070.60922970043 | 2953.03133078131 | 3046.68729181679 | 1708.7020880296 | 2810.72898827162 | 1896.37465604407 | 2296.1799642847 | 3306.51574088935 | 3562.24784016546 | 2034.58588586911 | 2089.91084777638 | 3011.96921697959 | 2137.14867885153 | 1628.37699637087 | 5406.85898043099 | 1992.15625315593 | 3390.95706296558 | 1921.44583642298 | 2164.66480983106 | 5691.83575480043 | 8555.6430159028 | 1830.91707755654 | 6629.58983750736 | 3312.22970188588 | 1818.71390621945 | 1990.27053762037 | 2056.60293351576 | 4318.93663567043 | 4374.00843865119 | 3388.4703452415 | 3385.79107849897 | 3556.28640850381 | 3422.54994238422 | 3369.92701571628 | 2944.0988639599 | 2916.88442308433 | 2843.68390739376 | 2740.78412697738 | 2767.26043890944 | 1800.41128197106 | 2911.02330409153 | 2140.99847692072 | 2405.92907661672 | 3400.23707917789 | 3471.85053493008 | 1970.0469808799 | 2347.8901834198 | 3014.62783067253 | 2254.75043323563 | 1541.72930910521 | 4948.47954493498 | 2302.42995124238 | 4052.02742521977 | 1909.99955019539 | 2373.9216814521 | 5254.97144010173 | 8133.98445159821 | 1882.85117349667 | 7109.13672433232 | 4119.87045631931 | 1749.84787330325 | 2065.8105015101 | 2480.82149781034 | x | M+Cl, M+FA-H | ||||||||||
13.70_733.4073n | 733.407330314993 | 768.405054709923 | 1 | 13.7003333333333 | 0.188700000000001 | 0 | 0.00108912612304268 | 2.12112747472548 | Blank | D6 MA_VO | 100 - 32.2 | 413.221089261224 | 7.8 | 537.988308153588 | 533.993051351272 | 285.807159744846 | 295.095837795188 | 292.795522537922 | 276.286182726103 | 264.125847135989 | 241.992518636577 | 209.255561569553 | 237.732950182393 | 191.085154262187 | 222.659198949444 | 222.669196105939 | 187.457858217233 | 272.577130324652 | 226.291821120233 | 193.174564560364 | 217.062047958115 | 158.480766112948 | 299.403476250917 | 199.447451245011 | 205.935522755942 | 166.977115044357 | 206.887917847257 | 265.838172649601 | 240.632396503387 | 287.632936438574 | 250.997344920213 | 198.203647012957 | 257.797810226522 | 292.469983632157 | 208.261560400017 | 320.604029349366 | 212.215525335041 | 299.411015147161 | 245.33867966533 | 333.137357429841 | 358.053301044325 | 206.100250978176 | 199.223299107141 | 348.576140158419 | 320.841685751877 | 299.427962605828 | 241.992518636577 | 198.735454695264 | 220.16391996479 | 177.351033239549 | 202.238015784232 | 234.620262727516 | 194.146855169061 | 307.738356979465 | 237.107753182283 | 198.649989488792 | 211.553777594935 | 153.453612834328 | 336.361947457822 | 199.623500097673 | 217.267620988396 | 158.092083582276 | 189.348498502865 | 307.241849088068 | 287.543915161034 | 285.919472100132 | 275.261110351541 | 182.990962713332 | 245.092435032754 | 300.765915968881 | 223.326019195056 | 398.778825013656 | 204.179934193919 | 310.775046742305 | 295.94505620863 | M+Na-2H, M+Cl | |||||||||||
15.94_1030.7984n | 1030.7984157737 | 1011.7805746537 | 1 | 15.9407833333333 | 0.182866666666666 | 0 | 0.00109010502407669 | 1.8869202509801 | Blank | D0 MA | 100 - 56.5 - 76.6 - 33.1 - 4.83 | 1145.67168134311 | 2.29 | 895.512229519875 | 1040.78823542074 | 1276.01659169758 | 1370.36966873427 | 520.312411626884 | 638.006983136994 | 648.815050618086 | 771.713484156599 | 794.597793487673 | 849.469199789972 | 839.880641759996 | 845.44476123396 | 732.807962419435 | 599.211789213704 | 630.373014151269 | 466.266698224273 | 717.904277918098 | 686.787571735423 | 557.26296886838 | 731.839242710465 | 691.608751178469 | 717.739655131452 | 682.459101828976 | 686.434884161686 | 826.36715067032 | 580.21825514858 | 770.374717509625 | 988.883443036399 | 756.96616350492 | 790.723363960657 | 984.089346279355 | 646.615911760907 | 523.85113238349 | 816.589171583047 | 718.228340321026 | 669.708562376169 | 554.526135915929 | 697.869873844764 | 920.156584026685 | 925.155598402861 | 619.437382612049 | 740.895668293597 | 735.533348292666 | 771.713484156599 | 754.650211464693 | 786.691406351653 | 779.514767587084 | 767.904814954229 | 772.139117931086 | 620.59326593422 | 711.68830425375 | 488.55256302409 | 738.252872923261 | 669.359321782116 | 539.586083340178 | 822.177738169785 | 692.219222389687 | 757.235008669444 | 646.144720725173 | 628.240720813686 | 955.071910354439 | 693.332365706535 | 765.785501747222 | 1084.47822276758 | 698.866893161292 | 751.75314538211 | 1012.00311209093 | 693.388435409673 | 651.584883315112 | 785.66882914934 | 745.488424750199 | 807.85034959094 | M-H2O-H, M-H | |||||||||||
13.06_1129.8442m/z | 1129.84422705411 | 1 | 13.0603166666667 | 0.0857166666666664 | 0 | 0.00111231633042175 | 4.64387949952185 | D6 VO_MA | Blank | 100 - 58.3 | 36.3528590962689 | 17.75 | 8.88055057728083 | 22.4319407136856 | 0 | 0 | 32.6515165957895 | 33.118679855706 | 40.9566322777666 | 12.2869871854806 | 40.7218075304964 | 16.0350002250395 | 37.6932457417909 | 28.7409524351936 | 26.2558526796525 | 15.9928103823095 | 26.366162234212 | 7.93879789068421 | 26.3863088279185 | 36.1927289034565 | 17.9193821376265 | 37.1707523072574 | 18.0730363786252 | 28.274856806559 | 34.2032405223383 | 24.8772142036415 | 53.898754556965 | 36.6007152202414 | 10.5874235956469 | 44.3245430122223 | 44.3360370026113 | 43.0021429655801 | 14.5083903291319 | 43.506832499765 | 27.6270117337166 | 41.6713449344493 | 37.2395581914366 | 31.8550644703303 | 5.49908447265511 | 15.0410766601572 | 0 | 0 | 38.8719729271296 | 38.459589147516 | 46.4307491716767 | 12.2869871854806 | 38.6745607853118 | 14.8499755859357 | 34.9840682509876 | 26.1049766623939 | 27.6650527399588 | 16.5634765625155 | 29.7672788474456 | 8.31824376820163 | 27.1342139853825 | 35.2742849015829 | 17.3509631245595 | 41.7591231441259 | 18.0889891386064 | 29.8307489156646 | 32.3832493932223 | 22.7681887149705 | 62.2933600866021 | 43.7360600860496 | 10.5243530273325 | 48.6093704666373 | 40.9331221512356 | 40.8828140231284 | 14.9199218750038 | 46.6538697361926 | 34.363471039862 | 40.093449586476 | 38.6529715078061 | 38.4258562818608 | |||||||||||||
17.24_1059.8481m/z | 1059.8481443244 | 1 | 17.23795 | 0.862866666666669 | 0 | 0.00111537239111736 | 2.45527137987131 | Blank | D6 MA_VO | 100 - 71.2 - 18 | 1149.35698500951 | 12.89 | 1594.41140515204 | 1548.81760696281 | 763.833822323076 | 690.365105600116 | 684.557492090337 | 697.636998958092 | 639.138893374215 | 568.484588624336 | 544.748957354885 | 576.49971581105 | 487.714177483874 | 523.495238538 | 546.942225213647 | 488.161681154525 | 532.734837701557 | 752.030401641097 | 542.315958850003 | 428.71983307071 | 606.941910190665 | 643.990208416443 | 582.897098173824 | 344.784390949271 | 499.519006274633 | 445.271923630353 | 551.216121960225 | 720.888096462315 | 402.889597962113 | 480.615069911296 | 509.807884858874 | 463.750308613405 | 355.400922054674 | 656.045943706158 | 663.728965008835 | 493.846856702328 | 415.940707022056 | 612.129167198607 | 987.303988057509 | 1038.51399467707 | 550.813151871168 | 466.075072267074 | 814.97287335899 | 810.141964321432 | 724.563910500785 | 568.484588624336 | 517.362267089422 | 533.89501621113 | 452.660038590231 | 475.482885117433 | 576.297623652199 | 505.58059348125 | 601.45524118159 | 787.97473976379 | 557.687601213631 | 417.84043350351 | 587.689163699192 | 723.484587951774 | 583.411611468994 | 363.756982637031 | 472.93906395452 | 407.522928560459 | 637.066749557601 | 861.425928768662 | 400.489535691828 | 527.075845513509 | 470.678703722713 | 440.894716232765 | 365.481895032343 | 703.500582323246 | 825.569963455847 | 475.147228479922 | 431.727578904448 | 738.39396641676 | |||||||||||||
2.80_644.4461n | 644.446082841779 | 599.446982841779 | 1 | 2.79715 | 0.234283333333333 | 1 | 0.00113564773541797 | 1.74907810731824 | D6 MA_VO | Blank | 100 - 27.9 - 14.7 - 2.86 - 0.0325 | 3187.86877593727 | 5.02 | 1744.65179821994 | 1771.33236964166 | 1823.77689645396 | 1950.6366888758 | 1935.84841832593 | 2072.76477412695 | 2175.99642838261 | 2482.4724155649 | 2687.33300836295 | 2720.66734716303 | 2967.37255796643 | 3000.30401925274 | 3016.096046354 | 3196.11560156885 | 2701.15782492353 | 2026.68418222991 | 3166.80056850578 | 2849.98535802605 | 2327.51982674602 | 2665.6669438763 | 3116.80153350807 | 3554.58891218215 | 3188.44507806744 | 2891.63957999143 | 2941.60777118714 | 2428.69477542547 | 3083.51982371288 | 3087.94594623443 | 2452.98812773552 | 3232.48729690483 | 3375.59093904487 | 2037.95427864253 | 2387.11086661582 | 2796.48326862928 | 2815.20399618418 | 2702.33011229612 | 1080.33702756285 | 1187.71471012954 | 1315.15556301293 | 1316.90192386578 | 2304.64784346023 | 2407.0307741639 | 2466.83232350487 | 2482.4724155649 | 2552.23012152576 | 2519.60356194655 | 2754.09458779797 | 2725.13120709152 | 3177.97548642663 | 3310.16154085301 | 3049.59506321803 | 2123.55236914764 | 3256.56175842029 | 2777.66276625661 | 2253.68879213492 | 2994.71781605083 | 3119.55268089312 | 3750.18872997841 | 3018.7844941831 | 2646.49390056246 | 3399.75633259652 | 2902.17117314524 | 3065.15092159676 | 3386.45586126111 | 2264.71442772873 | 3073.17654139385 | 3471.33982130281 | 2185.36831989822 | 2969.17436907525 | 2690.59376716979 | 2922.0539968219 | 3259.74378792895 | M-CO2-H, M-H | |||||||||||
13.03_529.4575m/z | 529.457540617476 | 1 | 13.0260333333333 | 0.3543 | 0 | 0.00114822493741173 | 1.52253307602809 | Blank | D0 MA | 100 - 17.8 | 403.568516528788 | 5.79 | 444.616212017226 | 475.253160815066 | 336.854365423436 | 357.550327859423 | 258.894791478057 | 244.661319368291 | 260.645909834361 | 300.049367213326 | 349.595819394816 | 319.148777764225 | 311.546342076761 | 301.577624270441 | 259.205919577292 | 286.498651795629 | 250.505781119822 | 264.045146406758 | 272.49417617435 | 296.899349356129 | 275.685690767551 | 253.835165550156 | 258.780113817312 | 271.086266297632 | 308.285542089032 | 260.689984005806 | 246.19442225424 | 224.32022034216 | 302.322165343871 | 293.428457526966 | 297.834281181396 | 343.922558114004 | 303.510598542323 | 272.163447229299 | 210.783383979987 | 307.177258280487 | 326.740087407852 | 270.088269759548 | 275.318752651404 | 318.666998813895 | 242.911231890915 | 241.387192869976 | 308.216964311166 | 284.116814564772 | 295.482909338527 | 300.049367213326 | 332.020251246221 | 295.562924325951 | 289.154151627619 | 273.918439593528 | 273.117979564707 | 296.721688731978 | 282.819902769735 | 276.665551115649 | 280.217871105264 | 289.365089441557 | 266.940691243615 | 285.168668336287 | 259.008534596043 | 286.003441139753 | 291.881337596469 | 238.589365487636 | 284.538630305225 | 268.051664465148 | 300.521195484677 | 321.794013611131 | 274.974667034527 | 326.972588156543 | 312.11969872319 | 291.850205690277 | 262.17995564973 | 295.545918624749 | 339.141383582203 | 325.799781283231 | |||||||||||||
0.86_252.1286n | 252.128643465759 | 297.14441859191 | 1 | 0.859966666666667 | 0.13715 | 2 | 0.00119187484365679 | 1.91679036301716 | D6 MA_VO | Blank | 100 - 13.7 - 3.94 | 478.400756366328 | 4.62 | 282.04961341908 | 214.318823040047 | 155.989218606151 | 345.979493527837 | 252.437901716936 | 245.409950201561 | 255.587931447088 | 246.9010547043 | 276.947759429123 | 279.236372783167 | 301.089071149311 | 339.695961998759 | 325.406737707834 | 515.349176475457 | 368.692445369129 | 279.1508689936 | 371.14235282676 | 619.82578910383 | 390.783519167015 | 348.600897697152 | 774.834259787571 | 398.65473080156 | 297.476536457841 | 442.637498418339 | 436.56924486575 | 344.616293525085 | 332.827107395914 | 530.12192195775 | 427.71147347153 | 439.800381059945 | 539.07360813686 | 351.906898748048 | 458.456765015032 | 416.701600146134 | 416.710808476199 | 437.699987463688 | 174.652983075082 | 143.705169704435 | 112.486395139011 | 233.57556188872 | 300.529969336478 | 284.986173923182 | 289.748899661595 | 246.9010547043 | 263.024497337851 | 258.600140962894 | 279.448490238015 | 308.540754878685 | 342.871917757283 | 533.73821123428 | 416.252116358771 | 292.493272705542 | 381.662175119554 | 604.096793378542 | 378.387512397266 | 391.632316041287 | 775.518192731247 | 420.591667711807 | 281.647490753243 | 405.111843063038 | 504.563888288284 | 411.799573575257 | 330.844415891767 | 581.368495775002 | 394.883421539547 | 418.125143218247 | 554.364470200988 | 377.361845718086 | 570.245016705738 | 400.923095339103 | 432.526909267395 | 527.985018787737 | x | M-CO2-H, M+FA-H | ||||||||||
7.40_773.4467m/z | 773.446700400074 | 1 | 7.39723333333333 | 0.148566666666667 | 32 | 0.00120317760138611 | Infinity | D0 MA | Blank | 100 - 20.7 | 84.5534780838151 | 114.16 | 0 | 0 | 0 | 0 | 0.34089731857438 | 0.596384630603497 | 0.0218566825704104 | 0.477360088073934 | 10.8258437901281 | 0.114193901613186 | 0 | 5.66323258861898 | 220.0176017205 | 83.1768561229618 | 34.9690431367387 | 0.0504113550599572 | 0 | 0 | 0 | 0 | 0 | 0 | 7.3980611897773 | 0 | 0 | 0 | 0 | 0 | 0 | 4.04171009888417 | 0 | 0 | 0 | 0 | 0.321675308167537 | 0 | 0 | 0 | 0 | 0 | 0.405841832788347 | 0.692561055175992 | 0.0247779685416807 | 0.477360088073934 | 10.281585693367 | 0.105754700793237 | 0 | 5.14382934570313 | 231.82635237872 | 86.144828457439 | 39.4798927820056 | 0.0528208358303411 | 0 | 0 | 0 | 0 | 0 | 0 | 7.00440241556675 | 0 | 0 | 0 | 0 | 0 | 0 | 3.84251739361781 | 0 | 0 | 0 | 0 | 0.333884372565508 | 0 | x | x | |||||||||||
3.66_728.5070n | 728.506978568309 | 683.507878568309 | 1 | 3.66001666666667 | 0.251433333333333 | 0 | 0.00122345313779937 | 1.64463423011247 | D6 MA_VO | Blank | 100 - 32 - 5.77 - 0.754 - 0.0274 | 13093.4245632401 | 4.11 | 6658.82910977627 | 6882.84665192218 | 8881.39072666235 | 9422.12881040117 | 8617.46880239958 | 8850.12388736725 | 9532.03950385435 | 11575.8565089326 | 12177.9897868479 | 13087.688430996 | 13125.685478286 | 13297.6858754604 | 14180.9496540323 | 13760.3168584706 | 11429.5491444373 | 10255.6870175976 | 13817.5463144291 | 10955.526866518 | 11192.3082085785 | 10917.6927383655 | 13297.5017529392 | 13676.7797308742 | 12995.4555858188 | 12403.9611833283 | 11110.4546387465 | 11356.3027516308 | 11890.6085315618 | 13223.475324653 | 11527.0693212732 | 13440.3501791848 | 13307.7687795936 | 9536.10733241008 | 10542.8343215133 | 11692.6430617653 | 11115.889439088 | 12352.7184665394 | 4123.33260702476 | 4615.08994932869 | 6404.51715567408 | 6361.01003743529 | 10259.1869815461 | 10277.3458995262 | 10806.0577905042 | 11575.8565089326 | 11565.7539489533 | 12120.4771405698 | 12182.2853823449 | 12078.0889299155 | 14942.067388485 | 14251.3217082957 | 12903.9096953435 | 10745.8718306538 | 14209.1969321588 | 10677.5141760475 | 10837.2780665234 | 12265.3765988513 | 13309.2392302159 | 14429.3774825383 | 12303.9534496524 | 11352.3856298125 | 12840.8820802309 | 13570.2249672437 | 11819.7747322985 | 14501.7808922531 | 10642.3345087348 | 12777.9524202119 | 13685.2446079751 | 10225.8951919567 | 13113.5565937174 | 11249.8983622195 | 11537.7888095298 | 14900.7321874244 | M-CO2-H, M-H, M+FA-H | |||||||||||
16.54_688.5897n | 688.589687949035 | 709.564355769035 | 1 | 16.5350666666667 | 0.200000000000003 | 0 | 0.00127360094094486 | 2.51528565982242 | Blank | D6 MA_VO | 100 - 31.7 | 249.676523340367 | 10.6 | 328.976156236271 | 286.913309136593 | 172.371126522512 | 210.445501466092 | 111.963305855333 | 144.918701361158 | 155.467271703557 | 131.803136487266 | 134.090553021217 | 130.017203647526 | 80.9983196046778 | 102.376797871623 | 91.3063987331761 | 50.5012640582595 | 127.33036132848 | 158.689372672997 | 138.067309686898 | 105.780339522672 | 146.920942712734 | 138.662803412292 | 140.468082961323 | 63.0534917129626 | 68.2322637333723 | 125.300901463112 | 152.816788524824 | 164.949339861138 | 109.372080822633 | 132.905062754043 | 61.6031810702816 | 105.579197629993 | 127.039561403359 | 105.63115890581 | 106.316592320225 | 99.2209472285552 | 94.2658503377923 | 119.858410865948 | 203.711206516946 | 192.381262621206 | 124.299658795798 | 142.074681220785 | 133.293489791579 | 168.289126813775 | 176.246470850372 | 131.803136487266 | 127.349289190354 | 120.408623188069 | 75.1766181314457 | 92.9873122762891 | 96.2069816306744 | 52.3032840139003 | 143.755406560182 | 166.274151766222 | 141.980750314969 | 103.09600702567 | 142.260477490539 | 155.779389002925 | 140.59207173474 | 66.5231619885338 | 64.6015517652142 | 114.678217075064 | 176.61764753384 | 197.10637335664 | 108.72053805277 | 145.75291685515 | 56.8749646141355 | 100.375804640087 | 130.643047793316 | 113.271917179936 | 132.240402127682 | 95.4639225560921 | 97.8436749580899 | 144.581784613773 | M+Na-2H, M+Cl | |||||||||||
0.86_368.2104m/z | 368.210374215516 | 1 | 0.859966666666667 | 0.0514166666666667 | 0 | 0.00128819526535839 | Infinity | D6 MA_VO | Blank | 100 - 59.8 | 14.0442283774201 | 47.76 | 0 | 0 | 0 | 0 | 7.48005658163409 | 8.09511298160527 | 12.0056747902731 | 10.9997824739415 | 3.92351326344104 | 3.08930907492761 | 3.95832470664102 | 6.10244283516464 | 5.35644815212638 | 7.87140331864907 | 1.67229270262956 | 4.50329830165413 | 9.14069005229777 | 2.9260597321009 | 10.904763213455 | 22.5307506131756 | 42.7612291480859 | 1.26242832649785 | 8.00613354049783 | 4.14712249459863 | 3.22833454748628 | 2.4241754700557 | 6.72973218930855 | 0 | 8.15379093496737 | 0.830365628711748 | 1.79249735017592 | 5.45115689644483 | 6.60680046123307 | 9.15927616464988 | 12.1283972870635 | 0.919763344366776 | 0 | 0 | 0 | 0 | 8.90508580456482 | 9.4005775813441 | 13.610310316615 | 10.9997824739415 | 3.72626269315992 | 2.86100178960063 | 3.67382269612213 | 5.54275743487525 | 5.64393860810589 | 8.15227600814728 | 1.88801095705653 | 4.71853970209323 | 9.39977779653203 | 2.85180664062386 | 10.5588542587871 | 25.3119544530039 | 42.798973753409 | 1.33189648631728 | 7.58011858402878 | 3.79554024048639 | 3.73114013671756 | 2.89677082481844 | 6.68964235725933 | 0 | 7.52796467390622 | 0.789441670313802 | 1.84334166775731 | 5.845462635315 | 8.21777608465174 | 8.81245800282337 | 12.5887260091077 | 1.10948430560796 | |||||||||||||
16.26_1053.8972m/z | 1053.89716782726 | 1 | 16.2607833333333 | 0.182866666666666 | 0 | 0.00129614101992104 | 2.56658934846342 | Blank | D6 MA_VO | 100 - 61 - 51.7 - 12.9 | 423.703135625004 | 11.33 | 646.717787739395 | 474.657441213282 | 272.945749675335 | 300.491563872005 | 316.023336784677 | 294.572670425475 | 271.498092760409 | 203.107899002644 | 188.980652440831 | 180.206967123502 | 183.199512871839 | 174.396713089397 | 211.451211616319 | 142.525935459988 | 232.30309003957 | 184.677626976582 | 185.776529624091 | 125.333226160632 | 216.896446256435 | 244.964839452895 | 217.051568701987 | 114.132951243366 | 152.235659058379 | 176.91628795569 | 245.94384153476 | 282.040803907405 | 189.136491260922 | 258.874745154519 | 125.671214697389 | 180.849139677191 | 206.040977095288 | 224.427957643559 | 248.216714799777 | 206.319438028774 | 192.088319406637 | 229.390749174847 | 400.465682144283 | 318.267556593858 | 196.825676311726 | 202.866028730621 | 376.229096611678 | 342.077157906356 | 307.785556196482 | 203.107899002644 | 179.479845647748 | 166.889243819323 | 170.032167188783 | 158.401922673313 | 222.800188311046 | 147.611641425664 | 262.269146222516 | 193.504550799418 | 191.042261392327 | 122.15271025895 | 210.01629475501 | 275.203386042236 | 217.243156407921 | 120.41339182856 | 144.135036287258 | 161.917785406117 | 284.249022222114 | 337.024931676476 | 188.009782209844 | 283.900014224679 | 116.025597456971 | 171.936123034227 | 211.885344381625 | 240.661801824321 | 308.7408791383 | 198.5071036303 | 199.378958763116 | 276.707522233736 | |||||||||||||
10.55_747.5480m/z | 747.548031914096 | 1 | 10.5515666666667 | 0.32 | 10 | 0.00129618225310824 | 2.42866506543865 | Blank | D20 VO_MA | 100 - 36.7 - 1.67 | 468.88881212544 | 10.16 | 558.672460168028 | 525.368927239466 | 400.870087317686 | 390.643773776579 | 245.894646611431 | 213.933573682938 | 208.325354667568 | 212.136377580858 | 184.322497455671 | 244.116595127918 | 244.545426664968 | 208.232421916997 | 117.368993706736 | 279.942767821109 | 200.733120626726 | 270.048997491639 | 318.599300685027 | 207.095005264919 | 284.060415241122 | 146.319302470382 | 146.486442102947 | 235.867381175203 | 159.185528459915 | 281.52622365932 | 172.635388055539 | 270.138556295516 | 200.289807920624 | 232.251905292103 | 209.641365742387 | 295.134136924 | 166.278782662986 | 268.258241266136 | 302.709861132211 | 159.818754738202 | 161.454914289241 | 148.274149662904 | 345.945560950875 | 352.270648818731 | 289.074023476447 | 263.729037891238 | 292.74015551358 | 248.433735419199 | 236.16937601389 | 212.136377580858 | 175.055874585411 | 226.07579837202 | 226.968883378194 | 189.134390266087 | 123.668404166858 | 289.931873311003 | 226.626792421854 | 282.956364606522 | 327.62981956892 | 201.839663344974 | 275.049761880273 | 164.381009017951 | 146.615743179003 | 248.846552022171 | 150.715095680557 | 257.659162960061 | 199.522947797767 | 322.802329369931 | 199.096657207515 | 254.703560120476 | 193.550804538068 | 280.588668369347 | 170.995292415111 | 287.662519301032 | 376.521414865957 | 153.767179728637 | 167.582874365368 | 178.858880369511 | |||||||||||||
3.66_966.7814n | 966.781419646686 | 921.782319646686 | 1 | 3.66001666666667 | 0.21715 | 0 | 0.00131574390342881 | 1.62730735944361 | D0 MA | Blank | 100 - 51.4 - 12.7 - 2.1 | 4353.10116584441 | 5.26 | 2541.72000528408 | 2705.8672442619 | 2593.31628328549 | 2859.22915097272 | 2921.83014025235 | 2964.42547100778 | 3210.54872742331 | 3460.62373327637 | 3376.37123765611 | 3601.14140485192 | 3650.85796354363 | 3634.63622453211 | 5382.03366175994 | 4673.2082860118 | 3948.69480717182 | 3408.46790843407 | 4620.2419670572 | 2953.36621501947 | 3232.07551188795 | 3731.62267917649 | 3797.66823443051 | 4494.91850862822 | 4234.83087561072 | 3418.11477058621 | 3846.53719041534 | 4492.90864428063 | 3575.8118437789 | 4414.5142500363 | 3326.37059413582 | 4124.7413729174 | 4128.18243065925 | 3000.45121777089 | 4223.76379317921 | 3360.99676246127 | 3515.96765247941 | 5034.88092704883 | 1573.90388053781 | 1814.33952472606 | 1870.0830914386 | 1930.30531577828 | 3478.46942350625 | 3442.4858167693 | 3639.65918036087 | 3460.62373327637 | 3206.62766668004 | 3335.00849348578 | 3388.45492495398 | 3301.2856491672 | 5670.89733925156 | 4839.9608365726 | 4458.05871800427 | 3571.38036877311 | 4751.20014004113 | 2878.42018116951 | 3129.55115259279 | 4192.25550505523 | 3801.02037120282 | 4742.26222769614 | 4009.49098064128 | 3128.33589440828 | 4445.62640192 | 5368.80553412566 | 3554.51029830515 | 4841.26274130096 | 3071.06234691251 | 3921.45653246773 | 4245.27862526045 | 3217.48682266031 | 5253.66935031179 | 3233.73182382338 | 3649.41487208369 | 6073.43334932683 | M-CO2-H, M-H | |||||||||||
13.67_219.9397m/z | 219.939671105402 | 1 | 13.66605 | 0.148583333333335 | 0 | 0.00133012185686177 | 2.2131322721426 | D20 MA_VO | Blank | 100 - 1.31 | 36.0350203399283 | 8.1 | 14.0169597464516 | 17.3926176093387 | 16.2388937698282 | 17.4809760267502 | 22.0573551065608 | 16.3349792893559 | 25.4428301090227 | 30.5148934821779 | 40.1666004587506 | 31.835089540707 | 36.8740351071133 | 38.2505491623598 | 30.5414144198612 | 30.7862555681586 | 26.7131207027112 | 26.5795483840487 | 34.9294107412611 | 35.5013283089126 | 32.0072250125516 | 22.4711720169964 | 27.572736045202 | 31.9275670543699 | 43.204459331307 | 29.5872734577389 | 26.9327316130791 | 24.2924783916281 | 23.909503707807 | 36.4362413808641 | 31.0450866123288 | 28.6473253217598 | 45.1956738272963 | 39.2519955983282 | 14.6623618225964 | 24.696376209268 | 30.3319721625481 | 20.0579774856377 | 8.67969221331155 | 11.6621070874737 | 11.7101337998579 | 11.8016497341421 | 26.2595125721321 | 18.9692522449253 | 28.8434277261343 | 30.5148934821779 | 38.147266174713 | 29.4824007371917 | 34.2237378471848 | 34.7424009506533 | 32.1806284864324 | 31.8847913756837 | 30.1589934014468 | 27.849954835942 | 35.919465341582 | 34.6004296192659 | 30.9919268782234 | 25.2450214537997 | 27.5970740275388 | 33.6844583441362 | 40.9055036908356 | 27.0789414012696 | 31.1274418542672 | 29.0283205719362 | 23.7670718901562 | 39.9585113648178 | 28.6622893792537 | 27.2354629937165 | 46.4776523993451 | 42.0912620917622 | 18.2375730941563 | 23.7612420734799 | 31.4832106693506 | 24.195366513409 | |||||||||||||
16.54_793.6615m/z | 793.661486948161 | 1 | 16.5350666666667 | 0.200000000000003 | 17 | 0.00133220567442327 | 3.10097644831877 | Blank | D6 MA_VO | 100 - 47.9 | 130.220234776867 | 13.09 | 160.520883294553 | 179.43580447094 | 91.6127675022304 | 89.3114838397438 | 69.5073091789603 | 64.0634698980663 | 70.2781957578789 | 50.0808379166537 | 67.6402596535943 | 75.9333403141834 | 58.4868792000655 | 57.3349608332633 | 45.3359552711022 | 27.8594466912531 | 61.0200722065869 | 51.7936559446856 | 70.8015596494207 | 35.4306608116242 | 66.8046481572662 | 70.7561058717825 | 60.9548631774006 | 29.8386328000982 | 43.6533766408328 | 33.5263280133176 | 68.1211791531255 | 75.0662603587267 | 36.3846552273223 | 100.323831242187 | 15.4305682779247 | 44.1137821896709 | 53.2358326943966 | 61.6283705007646 | 51.7903819493906 | 55.1377717242453 | 37.3522085431661 | 58.6723979870494 | 99.3990056337524 | 120.315389786038 | 66.063475778113 | 60.2954233161944 | 82.7491805079151 | 74.3947144746892 | 79.6713278899994 | 50.0808379166537 | 64.2397155761842 | 70.3216859369511 | 54.28317284584 | 52.076486256553 | 47.7692196438716 | 28.8535461425625 | 68.8913877010066 | 54.2692057068011 | 72.8083902358297 | 34.5315554141932 | 64.6855442795659 | 79.4902646541723 | 61.0086669921877 | 31.4805754503401 | 41.3305336286221 | 30.684053161205 | 78.7308941995064 | 89.7005004882706 | 36.16790741683 | 110.022076891783 | 14.246229002066 | 41.9396669268476 | 54.7458709569122 | 66.0862169042533 | 64.4187401596277 | 53.0499669356511 | 38.769897460938 | 70.774841308589 | |||||||||||||
15.79_1025.7559m/z | 1025.75590400541 | 1 | 15.7922 | 0.188583333333334 | 12 | 0.00138147248088627 | 1.881540845219 | Blank | D0 MA | 100 - 59.3 | 378.063862549815 | 10.76 | 343.47231040447 | 342.223803262731 | 411.463967562961 | 415.095368969099 | 156.234470311497 | 197.264893565844 | 191.124412362157 | 260.980300040215 | 242.484868889372 | 247.053525148583 | 301.670090335168 | 266.354235029528 | 215.28366028039 | 200.939583192263 | 226.871673088633 | 160.637542418759 | 227.913307789465 | 216.969286286343 | 187.111727790475 | 283.746514932543 | 198.213056119602 | 257.780341632705 | 183.150192493405 | 237.351997827541 | 257.884988145321 | 181.690166392834 | 244.652621655911 | 316.009979472998 | 255.753281381096 | 254.747182494314 | 300.632848405777 | 204.609590153699 | 221.610461392969 | 279.51947532816 | 274.902636318635 | 219.35767253639 | 212.68762927428 | 229.468084170928 | 296.713445033741 | 280.236649449173 | 185.998775352936 | 229.076967826775 | 216.669417318981 | 260.980300040215 | 230.294192966685 | 228.795682281742 | 279.987749048265 | 241.925562663726 | 226.838331566506 | 208.109644091588 | 256.137100857738 | 168.3154369923 | 234.373382954282 | 211.463369887719 | 181.176374505018 | 318.77228528601 | 198.388015392807 | 271.965325916544 | 173.404574226148 | 217.229913051184 | 298.049974614667 | 217.110840227698 | 243.195196273045 | 346.558477977351 | 236.123501672807 | 242.192155241361 | 309.160320994922 | 219.40988615657 | 275.647064025888 | 268.9354041761 | 285.336461684673 | 264.604907865044 | |||||||||||||
2.03_597.1462n | 597.146164439213 | 578.128323319213 | 1 | 2.0257 | 0.217166666666667 | 0 | 0.00143813519773006 | 2.86419450039872 | Blank | D0 MA | 100 - 23.4 - 22.5 - 0.678 | 521.28938320453 | 13 | 381.399870498088 | 372.323721259253 | 638.993126003475 | 692.440815057305 | 135.83976723485 | 159.839820264151 | 155.668968667025 | 182.182456889116 | 199.343511202966 | 197.825184944402 | 240.311323245341 | 248.822447750374 | 126.746649755155 | 228.080359169716 | 184.301084150237 | 188.880264083545 | 388.626095413916 | 212.584657718652 | 123.964376066125 | 220.823142557329 | 123.98992221212 | 336.657604190987 | 107.694908246765 | 279.662335728438 | 190.171768441919 | 125.431367071742 | 257.460898990547 | 204.398986626592 | 169.370499485901 | 218.528047409847 | 248.139760250152 | 163.97911065661 | 226.197109189073 | 170.491945121105 | 178.123194904593 | 202.625361485403 | 236.173431757077 | 249.65069698311 | 460.788469260942 | 467.476412554145 | 161.718667458821 | 185.616511393431 | 176.47512590814 | 182.182456889116 | 189.321722406427 | 183.205433456758 | 223.039103384487 | 226.00170284021 | 133.549376318936 | 236.218875430209 | 208.075096976684 | 197.908058787199 | 399.641484606119 | 207.190007752001 | 120.032113906761 | 248.081629526878 | 124.099365994986 | 355.182999860175 | 101.964346619656 | 255.953290598048 | 219.790578599326 | 149.884333514094 | 255.927173143897 | 224.158116220115 | 156.370839907587 | 207.75805355201 | 255.178262579592 | 175.840428467678 | 281.352101553313 | 164.036227229189 | 184.883793253752 | 244.421197977799 | M-H2O-H, M-H | |||||||||||
14.51_779.6416m/z | 779.641597182933 | 1 | 14.5119833333333 | 0.560183333333333 | 14 | 0.00154482297562386 | 2.10492001953706 | Blank | D0 VO | 100 - 35.3 | 414.760675426079 | 8.58 | 541.677102209853 | 470.571416308044 | 320.62065995475 | 326.173523231669 | 235.390526478268 | 261.022860870158 | 252.217882276329 | 200.3648037116 | 211.975379375738 | 229.723632553139 | 244.26898204718 | 239.169739321332 | 263.952180082202 | 246.658228029631 | 352.814343069437 | 270.073347988605 | 150.910319440475 | 153.383051899475 | 208.408315889253 | 275.47206108699 | 225.721268242646 | 172.925382482781 | 237.929904200476 | 176.167458246128 | 220.452877212116 | 195.988836605018 | 216.22365530767 | 359.713577982034 | 199.862676577251 | 216.420340633895 | 369.476842973478 | 214.651478630974 | 204.029493604599 | 309.587642930095 | 186.481257294617 | 273.485269364436 | 335.421561538709 | 315.527793029955 | 231.204839460478 | 220.204276228096 | 280.234890337251 | 303.116912597768 | 285.928421779466 | 200.3648037116 | 201.318536475009 | 212.746509950122 | 226.712308037281 | 217.234292336427 | 278.11898062866 | 255.459652259719 | 398.325810113492 | 282.981878969329 | 155.187787992827 | 149.490730201879 | 201.797415562284 | 309.476429925573 | 225.920508544026 | 182.441018226217 | 225.269398693301 | 161.232439530846 | 254.787899556896 | 234.197050040475 | 214.935584730341 | 394.486877601575 | 184.522657118128 | 205.754223552061 | 379.957080470771 | 230.178147829647 | 253.779223838486 | 297.865033488574 | 193.55908273386 | 329.897485079389 | |||||||||||||
15.35_983.7086m/z | 983.708614374666 | 1 | 15.3521833333333 | 0.154283333333334 | 18 | 0.00154826985523449 | 2.06450063926857 | Blank | D0 MA | 100 - 58.3 - 10.2 | 244.521785128055 | 7.11 | 237.523557749346 | 272.75894594678 | 184.380170236433 | 283.424466579662 | 107.107097735841 | 138.023303879848 | 169.078332201674 | 173.287007062842 | 164.343590159725 | 201.93829747393 | 207.315980755282 | 188.557021894342 | 135.280213097194 | 89.802860804247 | 148.846682145128 | 99.834757225146 | 175.019303047705 | 192.614242693812 | 195.669516013046 | 208.300455650297 | 160.418991811279 | 165.560197569083 | 100.357906744828 | 136.449155327526 | 142.005427856717 | 154.920422819127 | 205.00437766452 | 209.023963742802 | 223.498299627425 | 159.306680475883 | 206.023855460492 | 154.203987629694 | 140.381361350262 | 217.027385040689 | 174.010832105241 | 130.967960760054 | 147.081208191167 | 182.890471586625 | 132.959578042246 | 191.343794279035 | 127.512123097765 | 160.281737772442 | 191.676736983158 | 173.287007062842 | 156.081386184754 | 187.014577191618 | 192.415279648417 | 171.263519091138 | 142.540951751572 | 93.0072666792406 | 168.047236210278 | 104.606498184377 | 179.980127248574 | 187.726371531915 | 189.46270194294 | 234.013137710424 | 160.560590910577 | 174.670546270122 | 95.0177548404216 | 124.881350985059 | 164.122442613794 | 185.122309228165 | 203.783141686811 | 229.230187148847 | 206.344179988482 | 151.455368067366 | 211.867737090413 | 165.358228542978 | 174.611387282571 | 208.809591691873 | 180.615347283045 | 157.982917987233 | x | x | |||||||||||
0.89_491.2440m/z | 491.243952688713 | 1 | 0.89425 | 0.12 | 6 | 0.00157350538421031 | 2.26075993504996 | D20 MA_VO | Blank | 100 - 13.5 | 47.5222974271604 | 7.92 | 25.7452628722073 | 16.1419394416962 | 31.2401453004938 | 10.9546403762653 | 48.5049420060852 | 38.7977107736232 | 44.3986722659194 | 51.1746102378807 | 31.8121118387033 | 36.4192135194285 | 52.6688119391779 | 25.4322497364664 | 42.0580931891061 | 46.7978194442791 | 50.1755174311186 | 43.3246685121686 | 20.0308899860141 | 44.5420227246324 | 46.2187645575198 | 47.5992801114521 | 45.9367345739282 | 31.9798174929792 | 50.3621775870702 | 47.5305370100745 | 40.4287954395969 | 49.39398999585 | 55.4041467313119 | 29.7570699959699 | 49.7183391808312 | 44.9528133933419 | 43.7709450100465 | 51.6470921244218 | 50.219856463957 | 55.9355164624837 | 39.9930973309525 | 43.1856014794109 | 15.942184448245 | 10.8235017061204 | 22.5277833934408 | 7.39562988281313 | 57.7456421346036 | 45.0544533392874 | 50.3328399062111 | 51.1746102378807 | 30.2127908269711 | 33.7277470553425 | 48.8832753804418 | 23.0997315534214 | 44.3154286556624 | 48.467690606747 | 56.6479340231372 | 45.3954312508247 | 20.5986543530135 | 43.4117030487693 | 44.7526635316483 | 53.4749521159889 | 45.9772821435577 | 33.7395839889997 | 47.682352077801 | 43.5010217587328 | 46.7254861988447 | 59.0233961644967 | 55.0740974998109 | 32.6336684178988 | 45.9023175825494 | 42.7373470956415 | 45.0125110456726 | 55.3829495226738 | 62.4652640632535 | 53.8175048803887 | 41.5110201816974 | 52.0935601131543 | |||||||||||||
2.80_325.1764m/z | 325.1764199235 | 1 | 2.79715 | 0.491433333333333 | 0 | 0.00157707665955353 | 1.30688639264189 | Blank | D20 VO_MA | 100 - 9.47 - 3.6 | 1409.38535603042 | 1.97 | 1692.40506462527 | 1496.46162731859 | 1157.32955384955 | 1291.34517832826 | 1024.78976010028 | 1039.54088832074 | 1086.25262876368 | 1143.69659835601 | 1189.32012196141 | 1178.79994641867 | 1212.6925841892 | 1241.22682401959 | 1153.96200227646 | 1139.40240246865 | 1117.98250104909 | 1092.4894507883 | 1213.56161900625 | 1121.75287392999 | 1103.97890513777 | 1123.56971923817 | 1194.83662763569 | 1161.70247550645 | 1218.61096952634 | 1188.18177752355 | 1098.4785918056 | 1058.67190331491 | 1159.05177214922 | 1118.18998195517 | 1150.95840774573 | 1248.36417143601 | 1145.37577134202 | 1031.51366026254 | 1028.96257494852 | 1119.40906681078 | 1100.70261330411 | 1064.64532749749 | 1047.98439368535 | 1003.40823572836 | 834.569405909203 | 871.80506724467 | 1220.02295647592 | 1207.1832464654 | 1231.43726762369 | 1143.69659835601 | 1129.52828323115 | 1091.68382783583 | 1125.53109443967 | 1127.38773521269 | 1215.8972722157 | 1180.05932274663 | 1262.1972268725 | 1144.70650229169 | 1247.9593439656 | 1093.2867363974 | 1068.95969549731 | 1262.26356353613 | 1195.89128948321 | 1225.62795272936 | 1153.76737223815 | 1087.45081812196 | 1269.56407488876 | 1265.06101578001 | 1152.14715996337 | 1226.28474860876 | 1062.61913062895 | 1186.8394627404 | 1177.86443831964 | 1106.12750163441 | 1279.86066629829 | 1077.0223773056 | 1142.47936379639 | 1284.25131217915 | |||||||||||||
11.78_657.5324m/z | 657.532429115174 | 1 | 11.7801666666667 | 0.32 | 23 | 0.00157731736874944 | 2.25602572584764 | Blank | D0 MA | 100 - 30.8 - 0.242 | 370.854809500546 | 4.83 | 442.712442505735 | 375.859244996769 | 295.778816625913 | 369.068733873768 | 236.189923521266 | 232.38683148846 | 227.692354799479 | 225.65507455123 | 245.923890483477 | 238.342040875992 | 249.129988620612 | 214.327752010666 | 141.04784864469 | 201.904010241036 | 158.240169351456 | 156.344462152275 | 264.576819669782 | 247.215933100481 | 146.626245131064 | 190.533107741667 | 286.815866315349 | 221.654950802684 | 118.028582394973 | 353.069185407496 | 170.32011235988 | 272.003893596229 | 171.088795350423 | 210.950518092875 | 372.089476962883 | 459.707142574728 | 170.749632161277 | 439.607024350486 | 246.334845374602 | 137.796070162325 | 155.110016456105 | 177.029893483238 | 274.139885500201 | 252.021338215116 | 213.290977017687 | 249.163428766011 | 281.1865809003 | 269.862871988824 | 258.124900072461 | 225.65507455123 | 233.560321307959 | 220.727997408048 | 231.22393292887 | 194.670687304385 | 148.618146941275 | 209.108484472781 | 178.652441114079 | 163.817162988503 | 272.076101561272 | 240.942463323461 | 141.975127982772 | 214.052582079805 | 287.069033773118 | 233.852048431065 | 111.748154878151 | 323.136898568896 | 196.847073303171 | 325.031315983274 | 170.069598615968 | 231.342980372704 | 343.53056884209 | 437.050814654275 | 175.592957884275 | 471.405700455752 | 306.400142249487 | 132.578389321446 | 160.99715833986 | 213.546114493533 | x | ||||||||||||
18.08_1546.3752m/z | 1546.37520085752 | 1 | 18.0836833333333 | 0.268583333333332 | 0 | 0.00161632682324286 | 98.4907437601193 | Blank | D20 MA_VO | 94.8 - 100 - 47.7 - 13.3 - 2.26 | 3446.87050507987 | 13.43 | 4087.07328564572 | 3872.93572159296 | 2731.08771571352 | 3096.38529736727 | 413.743467640942 | 333.078165059977 | 295.181346422527 | 279.670872703955 | 378.014990500476 | 381.861551082848 | 359.586081367449 | 317.973453554491 | 0 | 702.483962297502 | 17.8476758490863 | 798.905821879182 | 400.154910490554 | 7.0546321919366 | 437.066397091636 | 67.3919595727623 | 44.0417878852243 | 0 | 35.1718585218148 | 75.9245110451989 | 19.4284162318007 | 79.4130006406584 | 24.9887047376797 | 25.5559821997887 | 24.8516268992036 | 60.7964415678092 | 23.9174059979143 | 30.4221172005374 | 833.35197285566 | 94.4412763942997 | 14.0900939911932 | 13.2992286716424 | 2530.82971017543 | 2596.88289265141 | 1969.43234086395 | 2090.41272441293 | 492.565937197213 | 386.79227064687 | 334.634228785022 | 279.670872703955 | 359.010677925364 | 353.641074599601 | 333.741065941601 | 288.810525782592 | 0 | 727.550465922389 | 20.1499459443211 | 837.090635853656 | 411.497077494367 | 6.87561047076736 | 423.202255562007 | 75.7108469438611 | 44.0806628178343 | 0 | 33.3003261895956 | 69.487828557424 | 22.4543468246717 | 94.8946419963 | 24.8398439884136 | 28.026463939984 | 22.9441950227107 | 57.800133725294 | 24.5958249568944 | 32.6226804256715 | 1036.55316258067 | 90.86523509029 | 14.6248781681072 | 16.0424804687527 | |||||||||||||
2.06_433.3256m/z | 433.32557224339 | 1 | 2.05998333333333 | 0.200016666666667 | 0 | 0.00163821893098004 | Infinity | D20 VO_MA | Blank | 100 - 24.3 | 99.5444954352578 | 18.75 | 0 | 0 | 0 | 0 | 2.03914803750225 | 1.17713148375761 | 1.4204151294669 | 4.11497259153903E-4 | 0 | 0 | 8.74516050115024 | 3.42354880295835 | 0 | 4.33392708612228 | 3.9036518225372 | 10.6980655444779 | 3.7319873427357 | 19.9368662040749 | 16.7784318128815 | 8.02771980320778 | 6.17373082470016 | 26.2057030420619 | 4.89928699785773 | 0.356681940521391 | 10.3617058936133 | 10.3954148087092 | 2.29577041699718 | 10.6001430541965 | 8.04818594532196 | 9.3654119576404 | 9.40974462660319 | 6.12224106351614 | 2.03657976122195 | 16.2358103832823 | 8.8049228388784 | 371.100668757649 | 0 | 0 | 0 | 0 | 2.42762712340346 | 1.36696249473615 | 1.6102627322641 | 4.11497259153903E-4 | 0 | 0 | 8.11660778522133 | 3.10955810547035 | 0 | 4.48857317748496 | 4.40720539047676 | 11.2093944539878 | 3.83776843547685 | 19.4309387502448 | 16.246204776333 | 9.01866438046884 | 6.17918027126639 | 27.6477349807435 | 4.63859067964569 | 0.326443373704768 | 11.9755174613568 | 12.4220109896015 | 2.28209423377741 | 11.6248526370301 | 7.43046516260165 | 8.90384452748471 | 9.67665271665298 | 6.5650892206964 | 2.53317117029018 | 15.6210375768213 | 9.13911034792726 | 447.648158962773 | x | ||||||||||||
2.03_177.0248m/z | 177.024788010529 | 1 | 2.0257 | 0.320016666666667 | 0 | 0.00180926824008143 | 1.67863306048132 | D20 MA_VO | Blank | 100 - 0.423 | 211.88696357838 | 8.64 | 112.416098470043 | 91.9447237062815 | 144.089520526425 | 156.453244785573 | 151.724260052232 | 150.510975712655 | 157.789491427819 | 191.364157981938 | 199.109493689065 | 235.224628940319 | 220.342575283062 | 209.740984625738 | 153.237699248148 | 182.462613370546 | 152.405897906416 | 169.678286473922 | 194.591512268297 | 206.512292183533 | 166.424218608813 | 170.225928731283 | 162.478029621816 | 205.583960284655 | 212.33768039921 | 185.034934210491 | 182.458387182939 | 161.710727623803 | 210.923998184935 | 182.167700364325 | 214.550450295848 | 221.429720681647 | 226.193303073852 | 185.374380262174 | 139.812154263914 | 203.395408275917 | 198.182247315956 | 169.830087923798 | 69.6111818961529 | 61.6508243943164 | 103.905326830626 | 105.623758759457 | 180.629322740239 | 174.783243574945 | 178.879070152177 | 191.364157981938 | 189.099469880937 | 217.840969625924 | 204.505596177793 | 190.504595181677 | 161.462249319189 | 188.973366647391 | 172.06557483322 | 177.788295973257 | 200.107099786556 | 201.271737469489 | 161.145091830584 | 191.2386776962 | 162.621446198559 | 216.896712945222 | 201.038964581589 | 169.34815395648 | 210.875856168345 | 193.236390528294 | 209.667498308786 | 199.777744614832 | 198.083103120951 | 210.516719993862 | 232.609292550847 | 198.78331039672 | 173.903387032094 | 195.693792956744 | 205.704179396471 | 204.861194268616 | |||||||||||||
0.91_248.9704m/z | 248.970412116739 | 1 | 0.911383333333333 | 0.22285 | 0 | 0.00187911175685429 | 1.3883174501305 | Blank | QCs | 100 - 0.793 | 91.7867872339617 | 6.08 | 104.843614326459 | 89.3345127976012 | 80.1234250816716 | 92.8455967301156 | 62.0566992291918 | 62.1232548102597 | 59.0480638833375 | 69.8586524419594 | 60.4587040612102 | 74.6651990928371 | 75.4785158818727 | 65.2204174291063 | 97.487873318077 | 88.3315624466541 | 77.1679085538045 | 74.4163824317798 | 71.1614303333381 | 83.7052763258316 | 95.5968442561253 | 74.2366759430102 | 78.6559148616193 | 69.9040965020837 | 89.4186980596656 | 107.78516696163 | 66.8801495624696 | 72.6250432457821 | 88.57955691523 | 74.5557066692741 | 92.9493040821206 | 83.7266337560761 | 83.9871482151286 | 81.0220308138594 | 70.4170277508939 | 86.475417941125 | 77.6012729626271 | 77.023633389293 | 64.9220886230461 | 59.9006244059273 | 57.7783216953204 | 62.6813520188744 | 73.8791512273961 | 72.1416091136072 | 66.9402167797058 | 69.8586524419594 | 57.4192052615879 | 69.1472633668095 | 70.0535467065678 | 59.2387283872187 | 102.720227362531 | 91.4834684674257 | 87.122222475543 | 77.9732168445355 | 73.1784612528925 | 81.5811311923794 | 92.5644258698752 | 83.400477528389 | 78.7253430918625 | 73.750737809088 | 84.6606331874378 | 98.6474209679701 | 77.2965771395983 | 86.7833657357838 | 88.0518777357572 | 81.7629629004715 | 85.8151850072142 | 79.6002282809969 | 86.3694497767939 | 86.8827044895073 | 87.5872322766582 | 83.2010057545735 | 80.5465998649699 | 92.9114134953441 | x | ||||||||||||
2.80_625.3952n | 625.395170935635 | 670.452698258294 | 1 | 2.79715 | 0.165716666666667 | 0 | 0.00189052097293418 | 1.84304503910661 | D0 MA | Blank | 100 - 14.8 | 76.0048774581425 | 13.38 | 45.7429006934146 | 43.0942672295387 | 25.7066313736532 | 50.4112090627873 | 82.2339219098696 | 76.4197132122234 | 85.7731211500165 | 52.1519434038529 | 60.4922169411757 | 50.0769825272875 | 62.9364997043529 | 52.1425165574881 | 93.3267336032721 | 68.4079148108925 | 66.8711675649836 | 75.4136938534219 | 44.6877743589614 | 43.1174268712487 | 52.7985642415955 | 72.0706362146677 | 62.2612008058967 | 75.6523128145317 | 74.6996822371258 | 57.5405778808765 | 88.8847197243511 | 56.3626639166941 | 73.714417425276 | 71.9930512874209 | 59.8459491852417 | 76.2221985873049 | 78.5226757197961 | 59.8291674309089 | 81.8405732093349 | 55.7836766241027 | 77.9274973425026 | 78.8881954993535 | 28.3252792434838 | 28.895590679648 | 18.537475347515 | 34.0333074722618 | 97.9003464293706 | 88.7435968377449 | 97.2372495565309 | 52.1519434038529 | 57.4510333161837 | 46.3761744628048 | 58.4129797740981 | 47.3602668847164 | 98.3357516011466 | 70.8488918816999 | 75.4972481045502 | 79.0181961515117 | 45.9544243150665 | 42.0232584212334 | 51.1237460170016 | 80.9670610884085 | 62.316157702557 | 79.8152635714179 | 70.7248319906831 | 52.6624374110379 | 102.728307870895 | 67.350619812672 | 73.2752916872741 | 78.9525771329188 | 55.2526051913899 | 72.4656436720609 | 80.7499771220804 | 64.1568696999846 | 101.796249064913 | 53.6714144934592 | 80.8852059675359 | 95.1605816217034 | M+Na-2H, M+FA-H | |||||||||||
13.36_765.4346n | 765.434642549761 | 764.427366117761 | 1 | 13.3631833333333 | 0.251433333333333 | 0 | 0.00192142362766889 | 2.30181078402633 | Blank | D0 MA | 100 - 42.7 | 1217.92225633373 | 9.77 | 1641.25874376971 | 1512.30272193609 | 853.846411529255 | 864.281148099868 | 784.132850616961 | 777.852700886228 | 747.569593686976 | 647.770259277567 | 648.179778508645 | 633.457065063058 | 584.705249454556 | 620.360773525958 | 466.334564187116 | 578.456616731659 | 507.998035341714 | 563.670163955536 | 683.405592599936 | 664.310242703448 | 381.515973000747 | 591.665816907928 | 678.510650147048 | 545.932884515422 | 381.080372333566 | 883.668135302712 | 490.233742879043 | 741.326882469969 | 442.346374104671 | 521.426105448769 | 987.181597773657 | 1212.61410153676 | 447.176738121726 | 1112.62210937381 | 756.30227401438 | 444.731273362838 | 453.323316766712 | 555.031483815872 | 1016.31316605113 | 1014.03001480507 | 615.722712720346 | 583.488208329353 | 933.518381942051 | 903.293712904919 | 847.487070163598 | 647.770259277567 | 615.593210713182 | 586.643081939944 | 542.679940426299 | 563.464399855078 | 491.36360072207 | 599.097493475266 | 573.527502320751 | 590.611562758933 | 702.776341675853 | 647.452388203953 | 369.413941179739 | 664.701255013449 | 679.109559888594 | 575.97415662265 | 360.802676813039 | 808.753050131842 | 566.586506919958 | 885.849275895559 | 439.71126302646 | 571.832059808174 | 911.412648919005 | 1152.85130870411 | 459.860938790608 | 1193.10287543028 | 940.715975400161 | 427.891418339168 | 470.529031432956 | 669.518658450088 | M-H, M+Cl | |||||||||||
15.02_821.6937m/z | 821.693743488221 | 1 | 15.0150333333333 | 0.760199999999999 | 16 | 0.00193469256532997 | 2.50891642316901 | Blank | D0 VO | 100 - 46.5 - 1.22 | 555.80319388328 | 12.59 | 707.827395982732 | 648.751155503445 | 380.126929986068 | 486.507294060873 | 319.81961811351 | 356.579438928726 | 287.140436987229 | 271.306557805919 | 233.623031989752 | 294.535609085357 | 287.084042039532 | 268.964943929488 | 352.605904273501 | 260.634640701453 | 522.693527738889 | 311.585310751758 | 206.119773612205 | 165.39473631188 | 183.102978426564 | 331.5071967933 | 333.489071753162 | 197.413085902653 | 292.735347350763 | 260.595488216806 | 362.686868897092 | 267.801879981314 | 261.808195212293 | 449.736692713674 | 231.953969207348 | 233.762302981692 | 538.106474856103 | 251.300660495479 | 282.619075016601 | 355.583379493807 | 250.587840599557 | 303.779474977138 | 438.306455066705 | 435.000965268226 | 274.115791023687 | 328.447832021831 | 380.74860934565 | 414.083495459371 | 325.518600171554 | 271.306557805919 | 221.877875749254 | 272.768727329124 | 266.450063475038 | 244.296830458675 | 371.530913780111 | 269.934780657029 | 590.118647292908 | 326.477963680796 | 211.96212324683 | 161.197600364704 | 177.294786297646 | 372.428562640432 | 333.78343685079 | 208.276216516947 | 277.158585405966 | 238.502880805745 | 419.174504283035 | 320.010115746108 | 260.248571994025 | 493.212473787513 | 214.150853276965 | 222.241500058921 | 553.36990411445 | 269.478323420547 | 351.531772355716 | 342.119130590814 | 260.098807110033 | 366.440521811619 | |||||||||||||
13.03_741.5085m/z | 741.508486017652 | 1 | 13.0260333333333 | 0.10285 | 14 | 0.00195769378530752 | 1.64656583428111 | D20 MA_VO | Blank | 94.1 - 73 - 100 - 40.2 - 27.9 - 28 - 16.1 | 589.06303306689 | 8.25 | 333.23701200943 | 399.449156118958 | 310.869322057071 | 387.454484156866 | 414.735952085272 | 374.100767330539 | 401.033304686156 | 443.622992470862 | 582.446312010822 | 506.115566242364 | 528.079823884679 | 537.014040322601 | 390.239647545283 | 475.128516406563 | 431.201073521022 | 403.84186614214 | 496.369531379048 | 449.281802221133 | 376.277043305923 | 474.592141628198 | 401.733376844586 | 550.253727002215 | 391.767939052745 | 466.923622855253 | 526.836578699429 | 480.654029868717 | 446.366350110632 | 533.328409870866 | 543.123390936426 | 697.855144405586 | 497.697209956573 | 617.576386968977 | 409.296557900791 | 506.459624663082 | 495.460956179899 | 403.384036723381 | 206.34964718777 | 267.838857801314 | 224.17298906919 | 261.575904168328 | 493.747500336475 | 434.43041431569 | 454.633980965266 | 443.622992470862 | 553.16442623952 | 468.712422630639 | 490.124430443208 | 487.761810316112 | 411.184529494628 | 492.082370612487 | 486.824077042313 | 423.144049342495 | 510.438847968477 | 437.880612288711 | 364.341195074494 | 533.175963770228 | 402.087980022656 | 580.532763876066 | 370.921546639067 | 427.339053063665 | 608.890149196891 | 574.357998318958 | 443.707291547085 | 584.884952985231 | 501.43715152269 | 663.461867624906 | 511.814427479889 | 662.248356277252 | 509.097782623155 | 487.28241099385 | 514.26598897878 | 486.590665542883 | x | ||||||||||||
13.36_788.5433n | 788.543294357355 | 823.524389160071 | 1 | 13.3631833333333 | 0.154283333333334 | 8 | 0.00204958880644912 | 1.87852415743549 | Blank | D6 VO_MA | 100 - 4.19 | 130.433211884373 | 5.95 | 160.301629620401 | 136.386015691705 | 108.480668548296 | 116.564533677089 | 90.9473002132423 | 97.8327294520619 | 96.3758460314214 | 75.0173456448232 | 76.3333511671132 | 110.694462143581 | 107.943399663182 | 106.223780040798 | 70.4136135891676 | 78.9367148007641 | 69.8156363573608 | 75.8085251084753 | 91.2079248124892 | 97.8637127220767 | 51.5796219648737 | 68.9486485795223 | 78.3900348890022 | 58.951947115964 | 56.0754477241175 | 119.443390678994 | 57.6727774977149 | 92.735753387927 | 62.5136837830264 | 64.8132860819553 | 145.065577499833 | 153.72925425529 | 68.1748630175201 | 152.132608834286 | 92.68914228713 | 59.1393546409622 | 58.7984365475836 | 84.9073765973003 | 99.2632376467777 | 91.4496228202308 | 78.2271970864695 | 78.6943358182931 | 108.273714677638 | 113.609799554197 | 109.257096700361 | 75.0173456448232 | 72.4957709072273 | 102.513878220192 | 100.185038108129 | 96.4814685668092 | 74.1928421568666 | 81.7533875703725 | 78.8215401581948 | 79.4318989150866 | 93.7931623996684 | 95.3802763337781 | 49.9434696920742 | 77.4596941932537 | 78.4592284315428 | 62.1959200195812 | 53.0916129803759 | 109.317290813745 | 66.6551783133064 | 110.814678289577 | 62.1412821757795 | 71.0787482557725 | 133.931388666751 | 146.152821189953 | 70.1086479606276 | 163.137017966552 | 115.2900895469 | 56.900028967243 | 61.0301089205703 | 102.421348210941 | x | M-H2O-H, M+Cl | ||||||||||
13.03_843.5114m/z | 843.51143433673 | 1 | 13.0260333333333 | 0.337150000000001 | 67 | 0.00210310318461648 | 1.46350524043221 | D6 MA_VO | Blank | 100 - 69.5 - 46.2 | 301.588787687041 | 3.45 | 226.698386105301 | 262.363696793579 | 156.355785136767 | 178.87378287221 | 267.436654884472 | 229.901914417669 | 259.658603812558 | 286.484939596536 | 309.692803254671 | 279.081781874723 | 276.63812742006 | 304.761802664916 | 314.126284381976 | 272.254587127048 | 260.041871029661 | 272.082713921918 | 209.367615317374 | 277.772631132645 | 255.175015084469 | 232.276288186645 | 284.800592427186 | 374.150293377127 | 299.582714063501 | 247.821550880352 | 286.696720640894 | 247.151966087798 | 269.59580903032 | 240.103664876983 | 312.256698716123 | 273.507093399633 | 324.434474275869 | 282.624016046597 | 258.013729357881 | 258.290587621703 | 270.462251856274 | 248.665145044155 | 140.377960145501 | 175.920243668747 | 112.750732302669 | 120.760175452929 | 318.386142275911 | 266.977222861967 | 294.363643527239 | 286.484939596536 | 294.123317961185 | 258.456974690117 | 256.754942166171 | 276.810581141867 | 330.986021686867 | 281.96935779995 | 293.586105485888 | 285.087285339786 | 215.302023207581 | 270.723739969203 | 247.080632749204 | 260.948555511286 | 285.051981037174 | 394.738814587602 | 283.641596388526 | 226.811884638377 | 331.349067363993 | 295.334481147605 | 267.98979405065 | 263.314344677717 | 288.290123682814 | 260.027497755489 | 333.637081712256 | 303.067432661956 | 320.926758280403 | 248.510353331817 | 280.727544113067 | 299.957676578379 | |||||||||||||
13.70_1858.5817m/z | 1858.58173245836 | 1 | 13.7003333333333 | 0.0858166666666662 | 0 | 0.00222099240982032 | 5.39989462563135 | Blank | D0 VO | 75.1 - 100 - 58.8 - 19 | 822.579647157031 | 14.01 | 1256.28717642329 | 1173.50766755074 | 402.63291885602 | 457.890825798072 | 302.598363967002 | 321.997367442192 | 288.84698874561 | 163.882120402532 | 201.981591275418 | 178.482231014879 | 199.975622826517 | 206.274125693455 | 166.493629340614 | 94.3994605217645 | 317.425976513141 | 45.6621204659438 | 124.8878954154 | 53.8202537963297 | 75.6275687139208 | 354.994429557259 | 147.822976870191 | 305.81900933115 | 50.6138083118532 | 211.842217400249 | 321.29570149337 | 261.797214741162 | 295.703292562199 | 229.069322408348 | 157.380223678444 | 658.263062960751 | 152.682297214187 | 276.315894268614 | 336.532275909117 | 266.494313289658 | 275.025736559846 | 244.770675487774 | 777.928040040549 | 786.860977130894 | 290.34523033777 | 309.128456802222 | 360.246525683153 | 373.924519708018 | 327.453243530522 | 163.882120402532 | 191.827175732441 | 165.291969809608 | 185.602505165538 | 187.355699134368 | 175.429649639403 | 97.7678853490263 | 358.37250307247 | 47.8446049690242 | 128.427772921388 | 52.4544852904398 | 73.228593814069 | 398.815067739858 | 147.953457682618 | 322.647437028879 | 47.9205932617123 | 193.882785431042 | 371.336758927346 | 312.834835204195 | 293.941752132098 | 251.21331882471 | 145.300851306108 | 625.821052752184 | 157.013141668631 | 296.303017171317 | 418.590951082426 | 256.403442983874 | 285.46423414888 | 295.259888959492 | |||||||||||||
0.86_338.1680n | 338.167972454258 | 293.168872454258 | 1 | 0.859966666666667 | 0.1543 | 1 | 0.00222169190666832 | 1.66876144935363 | QCs | D6 VO_MA | 100 - 12.4 - 3.78 | 949.948283961187 | 4.7 | 806.59126870845 | 673.107015950483 | 448.540765745396 | 558.013344290469 | 931.937333122476 | 896.32052089333 | 926.802544082379 | 934.188053452031 | 935.022902163697 | 947.649289674037 | 985.833761689972 | 1041.83186661158 | 608.01344861912 | 905.693368252871 | 917.862054056444 | 654.637816306806 | 691.861158238624 | 873.76916096982 | 847.6157620611 | 629.988822303475 | 1048.79410071386 | 552.018577030898 | 950.12774118027 | 726.231562892854 | 513.548824758383 | 455.193266330049 | 539.995525708809 | 768.276355041894 | 599.380418816195 | 874.908129118202 | 700.825560220466 | 737.75094007295 | 716.578500290069 | 759.097736291217 | 677.631263276231 | 807.521084179571 | 499.463798211029 | 451.332069597709 | 323.450134967223 | 376.722559782472 | 1109.48116840581 | 1040.86633670895 | 1050.67565526673 | 934.188053452031 | 888.015593077671 | 877.615754174649 | 914.977602070816 | 946.280281607173 | 640.646652305745 | 938.010926114401 | 1036.26214023423 | 685.927140469612 | 711.47157559068 | 851.595976763248 | 820.728623250712 | 707.754865775403 | 1049.71985332166 | 582.394729029051 | 899.57042456152 | 664.663540674587 | 593.532858517439 | 543.933634279535 | 536.778706773965 | 842.545177571066 | 553.376295157301 | 831.788926395896 | 720.704528158414 | 791.115654215989 | 891.306116631271 | 730.354320674679 | 703.350501033545 | 974.089666469127 | x | M-CO2-H, M-H, M+FA-H | ||||||||||
2.03_150.9727m/z | 150.972723384459 | 1 | 2.0257 | 0.21715 | 1 | 0.00223061617111964 | 1.37947184781672 | D20 MA_VO | D0 MA | 100 | 39.1406814632854 | 6.34 | 24.0401995328241 | 28.1721476172293 | 32.7889609302874 | 29.9863114764963 | 32.3126804078895 | 33.3519291558625 | 37.0880627519332 | 34.9349145433582 | 39.2892845445651 | 38.4668739777719 | 44.2658252629149 | 37.9117690901873 | 33.0245056316214 | 25.172172580891 | 24.7528820035795 | 30.5451269722929 | 35.7614383429479 | 38.0493811391718 | 32.834230915348 | 37.1353545657535 | 33.8235877958555 | 41.1834426510107 | 31.4102349786706 | 31.6365268418393 | 31.8246261658461 | 29.9525686390739 | 40.8540712111893 | 28.8298436747295 | 42.9856648810919 | 39.755792439253 | 33.7211154161223 | 40.1001531166743 | 22.1005221066012 | 36.4628605020122 | 28.2080291955595 | 29.3552214319583 | 14.8863616979661 | 18.8900032057186 | 23.6446598576426 | 20.244175400902 | 38.4685848920244 | 38.7304535748438 | 42.045120487927 | 34.9349145433582 | 37.3140564104933 | 35.624080537596 | 41.0842478992771 | 34.4346920847871 | 34.7969917852984 | 26.0703829160871 | 27.9458927064624 | 32.0050737636683 | 36.7750763000208 | 37.0838218420131 | 31.7926994055911 | 41.7193558928671 | 33.8534432980803 | 43.4496607926228 | 29.7388626714972 | 28.9544644157058 | 36.7812375938169 | 35.7918508927275 | 40.610698546823 | 31.6168076745594 | 39.6863948671411 | 37.7964574913633 | 34.6776173050918 | 43.0007705092482 | 27.4894244334492 | 35.0821856509741 | 29.278654252081 | 35.4103668795661 | x | x | |||||||||||
13.70_1308.0649m/z | 1308.06494136274 | 1 | 13.7003333333333 | 0.17155 | 1 | 0.00223109591497139 | 2.15744531370992 | Blank | D0 VO | 100 - 79.2 - 28.8 - 7.51 - 1.09 | 4477.66517078625 | 2.75 | 5039.43730509849 | 5172.62889840047 | 3697.88166416212 | 4000.71281548393 | 2393.92231581862 | 2437.05216936209 | 2541.33333170234 | 2592.39677573273 | 2462.4170055563 | 2414.94394021288 | 2422.43138612538 | 2457.03847135501 | 2253.25752789421 | 1747.53070917122 | 3172.78190689429 | 1165.88505629259 | 1863.7543331329 | 1543.45281159423 | 1594.17101185955 | 3300.41311910783 | 2154.01388330803 | 3524.32226923673 | 1426.46595499805 | 2581.52302922298 | 3522.89463211688 | 2699.72384637984 | 3184.8433156123 | 2916.84289917168 | 2212.58440604878 | 5263.81376333887 | 2535.09613465498 | 2999.08616612583 | 2721.8045147141 | 3032.60394305356 | 3232.64886303293 | 2614.96521692479 | 3120.56005922455 | 3468.35384367431 | 2666.60338303561 | 2700.9367934024 | 2849.98962229377 | 2830.06525541146 | 2880.99884984799 | 2592.39677573273 | 2338.62153807522 | 2236.47384161332 | 2248.32070780218 | 2231.69124606967 | 2374.19401710048 | 1809.88727132358 | 3582.0565354067 | 1221.61015275695 | 1916.58140671437 | 1504.28541471832 | 1543.60246511717 | 3707.81728408557 | 2155.91519450758 | 3718.25659209343 | 1350.56217089938 | 2362.66822403239 | 4071.57726870436 | 3226.03762386889 | 3165.87081714812 | 3198.81238346258 | 2042.7623641098 | 5004.39057912108 | 2607.00432071567 | 3216.02303092985 | 3385.47836874433 | 2917.7736763195 | 3355.34282536914 | 3154.35800486939 | |||||||||||||
13.03_681.5299m/z | 681.529930823402 | 1 | 13.0260333333333 | 0.5543 | 15 | 0.00224463903204775 | 1.21407135539642 | Blank | D0 MA | 100 - 37.7 - 32.5 | 1103.50531333985 | 2.97 | 1238.95569442533 | 1139.62153972705 | 966.653713874594 | 1068.79030533241 | 980.327256500514 | 945.816890271921 | 912.899474624455 | 962.506493068867 | 1024.38991349764 | 1028.58003165705 | 1060.08396288397 | 1071.65397330272 | 898.217527225737 | 899.332137192354 | 889.33694542702 | 948.831532864977 | 949.992686975674 | 951.031488022313 | 937.776772544304 | 834.098527391516 | 932.193002086778 | 1026.95887830066 | 981.736510781826 | 850.741796571841 | 892.110067974665 | 909.591653898102 | 960.642321598597 | 929.375369786642 | 1061.69421619695 | 1020.22892021281 | 1077.5683068387 | 956.298643337479 | 848.092336538553 | 928.646794609027 | 1035.31777365937 | 876.902875770685 | 767.195903253121 | 764.139632918303 | 697.069916710272 | 721.555181099626 | 1167.08987965751 | 1098.34477603346 | 1034.91435130161 | 962.506493068867 | 972.889770370704 | 952.56552191601 | 983.891118407789 | 973.367254488509 | 946.426519292317 | 931.422709343184 | 1004.0574205946 | 994.182254543712 | 976.919698054635 | 926.89765804511 | 908.029644912741 | 937.059945189105 | 933.015832899869 | 1083.46976449383 | 929.497257615586 | 778.618120722914 | 1031.05413395953 | 1086.91742741289 | 954.919658608613 | 1019.21753914236 | 980.206215460589 | 969.947689338714 | 1108.13361015877 | 1025.47185744688 | 1054.88775719468 | 893.483363732752 | 1074.61286734554 | 1057.78294402445 | x | ||||||||||||
16.23_1057.7826m/z | 1057.78256386556 | 1 | 16.2322 | 0.21715 | 1 | 0.00236486954101955 | 2.08108278127064 | Blank | D0 MA | 100 - 59.8 - 62.8 - 22.5 - 1.73 | 808.264726726486 | 11.74 | 662.641756403495 | 565.078772862181 | 923.770847227281 | 1081.56753041299 | 236.163306064969 | 292.041144795443 | 300.244113900969 | 417.228534924435 | 511.565312704122 | 550.162342906246 | 491.95687436435 | 515.94395924298 | 419.350074808259 | 376.110152645331 | 428.819086461633 | 329.267203312673 | 549.028331792808 | 434.613325729853 | 411.375601819733 | 434.853565592185 | 461.069452861981 | 356.469975070032 | 422.330442275769 | 484.649589498326 | 541.605701700644 | 381.727321000567 | 484.319682039664 | 639.855744238193 | 356.362087204256 | 457.415891491595 | 562.088819041165 | 438.690239856744 | 337.30679019872 | 472.581136602009 | 359.325015613898 | 412.711059293031 | 410.326247439392 | 378.896915346347 | 666.146375163709 | 730.181263232823 | 281.154892539438 | 339.137383855229 | 340.37366764591 | 417.228534924435 | 485.846895843609 | 509.50403777988 | 456.597794395385 | 468.624171224349 | 441.857367103025 | 389.530767222505 | 484.134824341143 | 345.004986868706 | 564.590232611132 | 423.584370073713 | 398.326395558586 | 488.532043826319 | 461.47643097911 | 376.085594174276 | 399.857786271273 | 443.562258378418 | 625.959528718557 | 456.145431784747 | 481.43453086798 | 701.710221993799 | 329.0103002382 | 434.872486193133 | 578.032509234889 | 470.422600977126 | 419.554319817969 | 454.686739909096 | 372.963060387752 | 497.841587013561 | |||||||||||||
0.84_474.1829n | 474.182867680694 | 519.135144232504 | 1 | 0.842816666666667 | 0.102866666666667 | 0 | 0.00236507317366441 | 4.84651869210895 | D6 MA_VO | Blank | 100 - 22.5 - 24.2 - 2.66 | 337.382082253053 | 19.91 | 26.4791873208042 | 38.8521545742483 | 89.6329809448771 | 123.488813265683 | 89.0279653270681 | 99.8823152186768 | 124.781926029485 | 268.705720915186 | 420.458254900226 | 464.97259830645 | 523.136847725778 | 496.395093028189 | 233.661272406124 | 270.862485311044 | 184.555125308956 | 130.08959365811899 | 350.905156504931 | 451.590917834401 | 300.80082684904 | 164.030038624202 | 283.690630564151 | 415.26268034794 | 278.965636449488 | 371.609381650631 | 194.509481274849 | 148.818705844651 | 260.707363142644 | 254.086943853694 | 277.364930645453 | 333.805433350576 | 440.328394615191 | 193.870712117282 | 117.875090826082 | 338.59304779584 | 256.721730272337 | 107.918660877673 | 16.3966509257747 | 26.0511670756609 | 64.6358190786867 | 83.3690131498572 | 105.988726367384 | 115.989913340436 | 141.459831690772 | 268.705720915186 | 399.320151116747 | 430.610017840697 | 485.536727476724 | 450.86822881207 | 246.202304045182 | 280.527582073808 | 208.361908304898 | 136.307406568989 | 360.85136679309 | 440.131130679584 | 291.259152486941 | 184.277964718686 | 283.941039429794 | 438.113509690054 | 264.121575596989 | 340.105305216875 | 224.803880106477 | 177.831056622365 | 259.154297714723 | 278.649378993353 | 256.076396406621 | 317.354078435223 | 452.818341522906 | 207.894218657068 | 146.61727837107 | 325.772141827636 | 266.465506240435 | 130.179204530529 | M-H, M+Cl, M+FA-H | |||||||||||
13.65_699.5788m/z | 699.5788361626 | 1 | 13.6489 | 0.131433333333334 | 20 | 0.00257839427424011 | 2.92122142248421 | Blank | D20 VO_MA | 100 - 32.2 - 0.551 | 115.344159856284 | 13.39 | 111.857837114355 | 148.340816789937 | 99.5980104946513 | 101.579975026191 | 62.5598484313205 | 43.2781072364937 | 45.0559332799333 | 54.8813846556396 | 52.9980136773273 | 50.6077757298408 | 47.6811516457874 | 43.0621274222589 | 35.2029036094696 | 63.9246154981507 | 36.3415776108743 | 35.1976438638759 | 53.7865269095462 | 82.5314168379383 | 34.5733411347672 | 32.0219212634603 | 61.3169936372618 | 36.3214712678998 | 13.3234254162442 | 88.1651235073257 | 29.4485104630571 | 40.9851560053938 | 32.4966776790528 | 56.3315409440302 | 98.0546542555582 | 137.312284970798 | 43.7984862424379 | 99.2398780820309 | 70.8734230019536 | 28.4103864986799 | 26.8501186256801 | 31.8057048895157 | 69.2654909025562 | 99.4655623267819 | 71.8217660404316 | 68.5780521309297 | 74.4781556291081 | 50.257384371887 | 51.0779480751406 | 54.8813846556396 | 50.3335933683589 | 46.867740785753 | 44.2540999225359 | 39.1126854242514 | 37.0923084021719 | 66.2056164776795 | 41.0294780442214 | 36.8799641655611 | 55.3110759148684 | 80.4370601243805 | 33.4766434754776 | 35.9747185717105 | 61.3711170984097 | 38.3201477218056 | 12.6144716534811 | 80.6907137455785 | 34.0350474026348 | 48.9752518469009 | 32.3030910230517 | 61.7770778132975 | 90.5286852747695 | 130.544950144585 | 45.040833487122 | 106.418327390295 | 88.1549131081461 | 27.3346204834263 | 27.8692047012062 | 38.3663152264571 | |||||||||||||
14.73_760.4914m/z | 760.491400411027 | 2 | 14.7291333333333 | 0.205883333333333 | 236 | 0.0027717064021886 | 13.4776529283178 | D6 VO_MA | Blank | 100 - 54.4 - 51.7 - 0.698 | 191.654261708692 | 19.78 | 6.01287671212507 | 24.4186754310384 | 16.9777141248001 | 9.47133830852274 | 111.213227329613 | 125.371767619482 | 125.494113654054 | 88.9239869051212 | 85.1554893066983 | 74.8874159407197 | 89.2187153501918 | 87.2103147640955 | 60.8252883548738 | 21.00177698411 | 214.347346658265 | 59.0645776865315 | 82.6885377265217 | 104.55457000125 | 25.2595979779827 | 248.389279803401 | 44.0061759309924 | 66.0252773662749 | 19.0338718885606 | 40.0990490489778 | 209.727479086973 | 64.1976310899764 | 183.204490984798 | 309.487445673021 | 3.81760949399779 | 0 | 264.39150504436 | 18.3662914334246 | 105.280680709909 | 135.635685716937 | 149.904215451935 | 82.9493458193378 | 3.72334087575918 | 16.3732230655222 | 12.2429093283767 | 6.39423205315884 | 132.400513440558 | 145.58994181987 | 142.267207764452 | 88.9239869051212 | 80.8743851787151 | 69.3530578613233 | 82.8061782861007 | 79.2118228082442 | 64.0898938149837 | 21.751176468163 | 241.997192519261 | 61.8876512575013 | 85.0322980543548 | 101.901343217985 | 24.4583406777678 | 279.050540523114 | 44.0450194295397 | 69.6584773063665 | 18.0210591415553 | 36.6995560099468 | 242.392045645735 | 76.7130214215179 | 182.113119579869 | 339.405414678384 | 3.52459728717577 | 0 | 271.890989295746 | 19.6948046741065 | 130.951898001211 | 130.499808344882 | 155.593773131715 | 100.059431494699 | x | ||||||||||||
0.86_695.4130m/z | 695.413021600205 | 1 | 0.859966666666667 | 0.102866666666667 | 19 | 0.00284378185299206 | 3.42182318747109 | QCs | D6 VO_MA | 100 - 23.6 | 49.5335700192727 | 12.36 | 52.0564997870596 | 44.4664392629306 | 9.62193745109954 | 26.0354210207637 | 43.4280543227382 | 50.8618904479847 | 56.1084197397694 | 52.915404081788 | 41.9026498860958 | 47.0312413142414 | 58.7871703533832 | 45.2337300081812 | 19.2241794195114 | 32.5623106644409 | 38.3656371160146 | 11.1458388095553 | 18.6318778928004 | 27.4014059320959 | 15.0096320308196 | 9.8046086845203 | 39.8484533962554 | 11.0957322990639 | 45.7832991280753 | 23.5080588880822 | 15.0339073400234 | 9.29955997181369 | 14.6404088810086 | 18.9292559159535 | 18.7688513347788 | 46.771706543586 | 14.9368576773688 | 22.5973113596726 | 24.3321005916264 | 16.9571420493316 | 23.7554831762851 | 15.8461871077254 | 32.2348358008503 | 29.8156601916265 | 6.93853759765261 | 17.5768743746224 | 51.7015541057312 | 59.0641721958142 | 63.6076703203599 | 52.915404081788 | 39.7960375131141 | 43.5555207665121 | 54.561880768071 | 41.0851195303695 | 20.2559766011855 | 33.7242208604194 | 43.3146321428013 | 11.678569664528 | 19.1599880449305 | 26.7060547473768 | 14.533512923591 | 11.0148930549601 | 39.88362694426 | 11.7063016981229 | 43.347120654859 | 21.5151068244671 | 17.3754034047465 | 11.1125181913421 | 14.5531941870711 | 20.7591359311397 | 17.328289496863 | 44.4665974366975 | 15.360542730706 | 24.2318725585928 | 30.265142031229 | 16.3150558484506 | 24.6571135362789 | 19.1148038323407 | x | ||||||||||||
1.00_201.9842m/z | 201.984206062197 | 1 | 0.9971 | 0.285716666666667 | 0 | 0.0029882259367251 | 2.15919807330494 | D0 MA | Blank | 100 - 90.5 | 69.3297369746572 | 11.57 | 19.580270067982 | 12.4683266500688 | 58.273029576181 | 38.1144589946714 | 33.7132936522456 | 30.8669997495772 | 39.1259596634928 | 39.889931629299 | 37.7851005305737 | 47.1415367216548 | 50.789419652838 | 59.6565204941278 | 95.6390907878705 | 68.1560657186239 | 55.3201525148442 | 58.2036388772904 | 49.7283976298676 | 50.3282057821959 | 62.0750316932186 | 49.4919554245455 | 44.1560455278199 | 41.1157359959681 | 51.9620026457977 | 72.3839774935931 | 49.1129187702116 | 52.3525832629352 | 78.8715304015276 | 65.5517061123831 | 54.1883195740938 | 53.4110392393933 | 70.0719726711476 | 58.2178100949203 | 56.5098967533756 | 74.5745218540072 | 47.7579815964696 | 87.5290424912481 | 12.1246490478525 | 8.36026892907886 | 42.0216415559062 | 25.7316006939835 | 40.1360296478067 | 35.8447901231996 | 44.3553954074234 | 39.889931629299 | 35.8854936916641 | 43.6576650810954 | 47.1389631907701 | 54.1851241280318 | 100.772217262577 | 70.588056141304 | 62.4562039467327 | 60.9855626814493 | 51.1379212317611 | 49.051053157175 | 60.105955528641 | 55.6012599404308 | 44.195021313696 | 43.378228415783 | 49.1970487285018 | 66.2474522277123 | 56.7621415189357 | 62.5587700532522 | 78.4016831151399 | 71.8885509154221 | 50.0292144777381 | 50.7787155108509 | 72.0595692674251 | 62.4289559234053 | 70.2890424511712 | 71.750739917142 | 49.5706176864139 | 105.583789051509 | x | ||||||||||||
1.62_299.1947m/z | 299.194688513207 | 1 | 1.61996666666667 | 0.137133333333333 | 2 | 0.00304054608813542 | 204.187233002724 | D6 MA_VO | Blank | 100 - 7.65 | 52.9091729401708 | 48.42 | 0.496583324497254 | 0.301236204739318 | 0.103906915997706 | 0.134757024610579 | 11.899623183797 | 9.37545697317371 | 7.62138437565424 | 3.98215248595056 | 6.26091747294905 | 19.8094687601644 | 8.83415051385813 | 13.4744913743237 | 12.2328462277099 | 1.62611967998678 | 6.5438267431295 | 1.64368730223054 | 3.68328088280655 | 4.09761350480388 | 32.1128694114312 | 29.6964571138048 | 166.675168717235 | 27.652694290936 | 11.9409753463893 | 5.36785340612248 | 41.5449100642483 | 10.2618866900757 | 12.0686191412517 | 0.680882652057308 | 0 | 0 | 5.18954121414357 | 3.97242309336915 | 0.22402994499184 | 0.286979614275513 | 19.4596948984388 | 13.134909279781 | 0.30749823733997 | 0.201985058097741 | 0.0749289887790558 | 0.0909763391492322 | 14.1666261928932 | 10.8873972280737 | 8.64003133575599 | 3.98215248595056 | 5.94615632417721 | 18.34550192269 | 8.19920169871861 | 12.2386787166324 | 12.8894056566545 | 1.68414397241272 | 7.38795102835827 | 1.72224962102832 | 3.78768141819804 | 3.99363050436414 | 31.0942201411941 | 33.3621983033555 | 166.822290036845 | 29.1743504088476 | 11.3055832352463 | 4.91278076172227 | 48.015433077633 | 12.2624514349701 | 11.9967249111652 | 0.746703176816369 | 0 | 0 | 5.3367429277571 | 4.25976562499898 | 0.278656504763908 | 0.276113063194888 | 20.1982802425653 | 15.8442666700687 | |||||||||||||
13.03_426.9628m/z | 426.962847192786 | 1 | 13.0260333333333 | 0.302866666666667 | 0 | 0.00320960625819755 | 1.34978204285062 | Blank | D0 VO | 100 - 0.243 | 335.366777575906 | 2.44 | 376.720747153346 | 406.249875333726 | 273.157635212919 | 285.338852603634 | 329.248894689143 | 311.53935416337 | 293.525094573368 | 272.209563823497 | 280.78852396433 | 272.744372362372 | 276.371216778186 | 279.208330533923 | 264.017703743771 | 271.689779833852 | 240.927370739053 | 302.205285586968 | 226.893828893242 | 283.707067540529 | 232.700149778284 | 250.538749930563 | 257.922042202603 | 275.090489202737 | 274.116389849107 | 258.75572207382 | 254.79986993252 | 248.407820378844 | 263.131392215254 | 258.780736353788 | 286.277831249017 | 279.733314066711 | 248.143459732885 | 258.297036223428 | 256.698630770495 | 273.789452391379 | 264.89262084999 | 241.815700327265 | 233.275988146257 | 272.398879618379 | 196.978470463257 | 192.636222875487 | 391.974261994743 | 361.779986901905 | 332.756608241129 | 272.209563823497 | 266.672171409481 | 252.587914807628 | 256.507215552862 | 253.600745102966 | 278.188021066048 | 281.384396674323 | 272.005920431811 | 316.649607178088 | 233.325007499265 | 276.507581279993 | 225.318690503538 | 281.465342004473 | 258.149705576201 | 290.22800605627 | 259.530362611575 | 236.819085249216 | 294.484356423312 | 296.835165448499 | 261.563886551723 | 283.796917648577 | 264.305206958769 | 265.946863722968 | 255.182066998422 | 276.980777244068 | 319.290991348468 | 263.422349915274 | 274.946519872977 | 291.695386651234 | x | ||||||||||||
0.84_322.1745n | 322.174504960869 | 367.191376120561 | 1 | 0.842816666666667 | 0.0857333333333333 | 0 | 0.00324846008427637 | 8.47045251450984 | D6 MA_VO | Blank | 100 - 10.8 - 4.84 | 187.344441379671 | 4.48 | 27.9593727435 | 26.4873556588428 | 11.1133331008333 | 22.9095644388859 | 57.9028977563051 | 60.1880622661349 | 57.5816546991062 | 58.6749050035735 | 56.173651332911 | 55.4148205028206 | 51.8422847766761 | 55.5382365724931 | 20.277729278102 | 20.9471259627448 | 34.6225840908713 | 25.3313567378174 | 15.7571375351445 | 26.2250690936634 | 33.1957628520494 | 64.2999607339899 | 428.991177367425 | 245.024161026132 | 34.6177416508371 | 40.7446854742901 | 106.053067838832 | 34.8644258582587 | 19.6857617250789 | 33.661252282163 | 22.6513127112179 | 27.0096343667765 | 32.9023874349649 | 34.5811074327269 | 43.6646732607478 | 38.4148833220215 | 71.2587332844002 | 56.7832826123221 | 17.3132230013193 | 17.7603156175623 | 8.01400756835696 | 15.4665651766672 | 68.9340070125775 | 69.8943362605633 | 65.2778125919218 | 58.6749050035735 | 53.3495791261379 | 51.3195335214824 | 48.1161543194874 | 50.4445485188624 | 21.3660724246844 | 21.6945753524203 | 39.0887420739146 | 26.5421041354009 | 16.2037647805945 | 25.5595691952709 | 32.1427632221824 | 72.2371706727306 | 429.369840539635 | 258.50720574282 | 32.7756944719037 | 37.2904570590932 | 122.570586231097 | 41.6612794320243 | 19.5684912514376 | 36.9152657051289 | 20.9127611031069 | 25.6784844311939 | 33.8356660452596 | 37.0825083970072 | 54.311691380995 | 36.9602946644654 | 73.9633314972478 | 68.4960552789221 | x | M-CO2-H, M+FA-H | ||||||||||
0.81_203.0097m/z | 203.009658559797 | 1 | 0.808516666666667 | 0.0685833333333333 | 0 | 0.00331198954138523 | 2.60626617014597 | D0 MA | Blank | 100 | 57.7566252759626 | 16.37 | 20.9782517866493 | 11.2228160057319 | 24.867963993524 | 31.5736800561135 | 32.7081357141207 | 38.8164984574245 | 31.3016768904725 | 39.4012915498676 | 43.5927276072628 | 32.2075786983854 | 44.7260469435568 | 48.1822245177347 | 77.6745399361195 | 68.7979365370935 | 53.9754913634497 | 30.5785332671878 | 32.7211626267365 | 33.6318690944443 | 51.6373068179082 | 13.565064223303 | 29.8307594399265 | 33.7680667430677 | 45.6506114561585 | 64.9510945701188 | 43.3796320375004 | 53.7298092965124 | 73.5988010071287 | 60.0151062316263 | 54.943026851059 | 39.0918764339908 | 53.6599246912009 | 40.26913916833 | 48.1862311254381 | 60.5181842382869 | 32.1018382807873 | 44.0537195309267 | 12.9903182983431 | 7.52512847816444 | 17.9326984843806 | 21.3158299782527 | 38.9393785812735 | 45.0762708333174 | 35.4853470006458 | 39.4012915498676 | 41.4011483253055 | 29.8273620605419 | 41.511391446332 | 43.7631929357184 | 81.8434758186349 | 71.2528306245708 | 60.9380875408134 | 32.0400767588516 | 33.6486256700275 | 32.7784106961018 | 49.9993247293831 | 15.2395405580286 | 29.8570905408789 | 35.6262359619159 | 43.2214934363419 | 59.4447097778293 | 50.1359087264312 | 64.2044876353855 | 73.1603640101725 | 65.8167311866765 | 50.7259958602198 | 37.1652620974073 | 55.1819923540206 | 43.1819800523981 | 59.9357677102028 | 58.2266488552173 | 33.3202513852811 | 53.1407461740804 | |||||||||||||
2.80_383.0962n | 383.096228053768 | 418.065629353768 | 1 | 2.79715 | 0.405716666666667 | 0 | 0.00334663165323157 | 1.50533623640809 | D0 MA | D20 MA_VO | 100 - 10.4 | 698.689137166091 | 6.79 | 587.487835047406 | 545.74295740842 | 346.541946872763 | 379.80247843595 | 722.645131806351 | 663.849412547695 | 689.924386258318 | 663.64513202771 | 624.880056592775 | 588.570053691406 | 635.074056499208 | 608.380615587517 | 670.901794737324 | 696.318452628139 | 658.387047621363 | 769.149253677537 | 395.153526142209 | 587.845533954851 | 711.121285354581 | 585.082340968458 | 661.901906866212 | 481.24232076965 | 807.784149687997 | 582.003827304614 | 546.347678587302 | 453.83979132141 | 575.539566624324 | 523.520054760975 | 514.800044312554 | 418.824816885678 | 569.456469173575 | 353.484984229765 | 646.914839539974 | 728.625059062004 | 632.166036888397 | 539.424231913894 | 363.78884433674 | 365.931854220394 | 249.89710645704 | 256.409928816396 | 860.316607869933 | 770.905596890978 | 782.137210611737 | 663.64513202771 | 593.464858212097 | 545.073327425457 | 589.428522266181 | 552.583001818602 | 706.910332000946 | 721.1649544042 | 743.316022331881 | 805.911811122917 | 406.353931705535 | 572.928084482356 | 688.563874831849 | 657.305112471049 | 662.486156354241 | 507.723838769042 | 764.801088310742 | 532.663057223139 | 631.440057464555 | 542.316298007646 | 572.111007520545 | 574.128429966515 | 475.287700974856 | 398.183344274573 | 585.609143298641 | 379.05408094337 | 804.655949331595 | 701.035498587792 | 656.159659210695 | 650.692075345892 | x | x | M+Cl, M+FA-H | |||||||||
13.48_711.5762m/z | 711.576193811103 | 1 | 13.4831833333333 | 0.120000000000001 | 18 | 0.00343414421305654 | 3.60816762431386 | D20 MA_VO | D0 MA | 100 - 6.77 | 67.0056703015148 | 15.06 | 22.0267165141987 | 48.3719071519358 | 7.99592219461091 | 6.61355787277488 | 32.6987854781857 | 40.2893382021176 | 29.1283568808102 | 35.4817792328067 | 44.0316978462736 | 45.8340073663207 | 42.7250422326936 | 40.5955999802973 | 27.5607738780201 | 11.6228405397845 | 27.901127176099 | 7.1974728464601 | 17.2384841978716 | 36.0028584883065 | 29.1921769588565 | 43.1631340966736 | 77.0648570452664 | 27.692637378292 | 24.923420566373 | 69.5333412597175 | 36.2902653076136 | 49.836820153179 | 23.4125374339821 | 29.9184839677214 | 77.6826186810692 | 81.9871483879068 | 36.7942446323655 | 71.5586695047178 | 25.4416525070439 | 26.8662773491755 | 45.0843211101619 | 40.1478378476761 | 13.6395568847595 | 32.4343565702448 | 5.76599121093568 | 4.46490478515216 | 38.9282470273359 | 46.786629208344 | 33.021548816409 | 35.4817792328067 | 41.8180497896831 | 42.4467652537111 | 39.6542076459522 | 36.8723754882898 | 29.0400114668679 | 12.037574526834 | 31.5002473788656 | 7.54148606328951 | 17.7270993854877 | 35.0892327289145 | 28.266174695565 | 48.4912066651257 | 77.1328808759981 | 29.2164914608071 | 23.5972186145901 | 63.6384855162744 | 41.9423896345555 | 59.5525564897064 | 23.2730661047864 | 32.8106861831851 | 71.720260412828 | 77.9464721679647 | 37.8379160548486 | 76.7348173550992 | 31.6452426182982 | 25.8489793926706 | 46.7954794297371 | 48.4291924318386 | x | x | |||||||||||
13.91_793.4663n | 793.466340995684 | 792.459064563684 | 1 | 13.90615 | 0.182966666666667 | 0 | 0.00356502117060009 | 2.73233208273792 | Blank | D0 MA | 100 - 44.8 | 828.342524326894 | 16.83 | 1164.46686288618 | 1080.76261142827 | 515.522790203412 | 552.617832789705 | 536.317517035872 | 537.093559070056 | 527.636741116519 | 434.316083862276 | 394.101838359651 | 387.1137771447 | 364.512965547088 | 350.95647772207 | 241.550029524753 | 314.090055739214 | 292.377250556161 | 364.63544465282 | 410.658128555158 | 464.790882735054 | 242.523520586501 | 341.505698569579 | 355.232975977691 | 267.258626510917 | 229.294761051372 | 626.100608430226 | 305.677621955847 | 494.617220377088 | 248.869163205505 | 284.174148543478 | 698.610597978138 | 894.569710871829 | 259.098258097148 | 814.741823290583 | 524.210122811093 | 248.001826332856 | 276.767590434442 | 297.71326789206 | 721.070342305234 | 724.673513424842 | 371.751976195231 | 373.079975022267 | 638.491628448651 | 623.708363546158 | 598.158779618244 | 434.316083862276 | 374.288776150935 | 358.505148668557 | 338.313833529353 | 318.768512668772 | 254.514465314609 | 325.297627645879 | 330.092603870182 | 382.063702453991 | 422.298003397219 | 452.996126956559 | 234.830455102517 | 383.661283019107 | 355.54653404754 | 281.965176253099 | 217.093740776883 | 573.021427986523 | 353.286199865469 | 591.04332633488 | 247.386619372485 | 311.645096031382 | 644.990280513853 | 850.481501574706 | 266.447599014267 | 873.675620780534 | 652.031408523173 | 238.611178426601 | 287.272199427077 | 359.123029114522 | M-H, M+Cl | |||||||||||
3.15_603.1979m/z | 603.19792303618 | 1 | 3.15143333333333 | 0.371433333333333 | 0 | 0.00368452918706386 | 1.55388281087001 | Blank | D20 VO_MA | 100 - 8.71 | 206.9501786185 | 4.97 | 170.021809363391 | 201.373925177054 | 213.950752145689 | 242.454227787864 | 108.545197449658 | 118.583825690254 | 131.68510294564 | 131.454689281791 | 155.947380985301 | 162.511904720084 | 184.505650965784 | 177.204261537514 | 152.950579283929 | 129.429280562734 | 124.340902652331 | 145.02031054715 | 155.470637209301 | 164.204821745847 | 146.316108543208 | 150.665018429863 | 142.908151691633 | 148.546764596917 | 142.471699290762 | 160.070793212584 | 148.628492521659 | 117.314083280344 | 160.164896851968 | 138.428197985958 | 164.10221179587 | 172.575214788335 | 137.658515588391 | 142.878734157435 | 119.910255915277 | 151.776993449038 | 148.322465507494 | 112.720751469161 | 105.282243904435 | 135.02534999555 | 154.283411771636 | 163.684216975968 | 129.224195888565 | 137.707337232588 | 149.285662528327 | 131.454689281791 | 148.107287740346 | 150.501888596712 | 171.24442745782 | 160.951976881916 | 161.1597190967 | 134.047662909544 | 140.380321129646 | 151.951757820544 | 159.877365416773 | 160.037881639908 | 141.674829208063 | 169.263161695446 | 143.034294271969 | 156.720908163787 | 134.890627295846 | 146.500407874675 | 171.777034179803 | 140.184577389117 | 159.210775107691 | 151.809970315384 | 151.506908033586 | 164.069972439285 | 141.563209385384 | 153.213770537974 | 149.148689921403 | 146.029921635797 | 153.951988467658 | 135.971829533467 | |||||||||||||
2.80_420.0634m/z | 420.063403867801 | 1 | 2.79715 | 0.268566666666667 | 0 | 0.00375877243969291 | 1.5798134630771 | D0 MA | Blank | 100 - 1.71 | 144.439858524043 | 9.12 | 124.656263262001 | 104.571449668422 | 71.8318621625308 | 64.6541294673515 | 144.825920650548 | 139.286243557304 | 153.222292654815 | 145.712331273887 | 122.383781901257 | 118.255211654233 | 129.624350158094 | 129.019525009176 | 136.472378055039 | 138.979894462823 | 136.532494659316 | 165.774666918996 | 94.4308084607778 | 136.352740600554 | 146.549226893787 | 138.828209934674 | 131.050008319339 | 97.5161375791127 | 179.55844734524 | 123.82275095774 | 113.846039462928 | 78.3978904859174 | 114.771990408301 | 114.591580817262 | 114.606587451487 | 87.0183726990687 | 110.803955770117 | 66.2344603291633 | 121.661839397204 | 151.867919898499 | 130.100929544949 | 115.277727261798 | 77.190633143511 | 70.1173033132576 | 51.7991390878523 | 43.6489008778424 | 172.416777338933 | 161.748346385003 | 173.701435936347 | 145.712331273887 | 116.231063877307 | 109.515870366674 | 120.307684405456 | 117.186502324587 | 143.797102402473 | 143.93906821669 | 154.14457379723 | 173.698097496949 | 97.1073968813828 | 132.89258822913 | 141.900552833659 | 155.965213365044 | 131.165683919412 | 102.882197963001 | 170.003949691348 | 113.32538032333 | 131.57729504125 | 93.681635134151 | 114.088279721161 | 125.6690814109 | 105.810211300836 | 82.7297362947435 | 113.946918026601 | 71.0254851180097 | 151.327372467139 | 146.117405133709 | 135.038861014102 | 139.056236548733 | x | x | |||||||||||
2.01_615.0201m/z | 615.020050957173 | 1 | 2.00855 | 0.1543 | 0 | 0.00389901123454972 | 29.4051059994361 | Blank | D0 MA | 100 - 14.1 | 81.7717832470769 | 4.6 | 76.7392451664277 | 85.3081089529394 | 83.8327714609396 | 81.207007408001 | 16.1620296895304 | 17.1424864444274 | 7.86281155391522 | 15.1402700129295 | 12.1885686079666 | 7.20949564581211 | 11.2969547396623 | 3.59288837119876 | 4.60420232497119 | 0 | 2.78751748025737 | 3.73176102815392 | 28.2644997418375 | 7.51072490411718 | 0 | 19.5990345875124 | 0 | 31.7787146593738 | 3.39033383834599 | 5.80923365693601 | 10.846509098573 | 13.908376858184 | 14.5940491189143 | 18.8160059789545 | 5.82392515289232 | 15.579982197794 | 13.2531522769389 | 22.1082156261273 | 13.6891841760443 | 0 | 6.70310569523563 | 15.7033133998563 | 47.519079798675 | 57.2008379868521 | 60.4531924732765 | 54.8239787023653 | 19.2410658382681 | 19.9069826602993 | 8.91372680663937 | 15.1402700129295 | 11.5758009307845 | 6.67669677734324 | 10.4849934746396 | 3.26336669921488 | 4.85131835937216 | 0 | 3.14709472656136 | 3.91012573242165 | 29.0656411696865 | 7.3201291561063 | 0 | 22.0183463622317 | 0 | 33.5274149875243 | 3.2099305368956 | 5.31674194336102 | 12.5358276367204 | 16.6198283915651 | 14.5071105957106 | 20.6349381894644 | 5.37692260742551 | 14.8121342507488 | 13.6290789042542 | 23.7073984167101 | 17.027099728587 | 0 | 6.95751953124233 | 18.9424593509743 | |||||||||||||
13.03_512.2311n | 512.231066125867 | 493.238729266068 | 1 | 13.0260333333333 | 0.691433333333334 | 0 | 0.00395902679281657 | 1.30048701784536 | Blank | D6 VO_MA | 100 - 6.18 - 0.0962 | 13491.802408654 | 3.55 | 12848.5538446058 | 12804.5556494697 | 13644.160347051 | 14669.9397934894 | 9584.89372720208 | 9700.40385126344 | 9913.68980763126 | 11249.5254632915 | 12590.9453027136 | 12337.2394555797 | 12188.3287875344 | 12696.446767524 | 10861.9685298841 | 11111.240287761 | 10111.0033768378 | 10342.0467523187 | 10891.3909931489 | 11530.9666657358 | 11369.0315162076 | 10202.1872639312 | 11255.4548293278 | 11125.3186603299 | 12027.3527740101 | 11651.4766628114 | 9944.23512670571 | 9478.33687140431 | 11229.117387737 | 10846.002551154 | 12464.1700140415 | 12083.2731722639 | 11704.2324903775 | 10982.3101287673 | 8989.32332118795 | 11841.2011654224 | 11166.0121699689 | 10159.0081794223 | 7956.18270827741 | 8585.71737421817 | 9839.02878578744 | 9903.88012653209 | 11410.916500009 | 11264.7469135246 | 11238.7181080269 | 11249.5254632915 | 11957.9485534786 | 11425.4881285946 | 11312.3005933084 | 11531.9924525426 | 11444.9504232591 | 11507.719011687 | 11415.2774405391 | 10836.3592489077 | 11200.1013758272 | 11238.3513396519 | 11008.395550953 | 11461.5488751019 | 11265.3898267244 | 11737.5161201903 | 11387.3644272582 | 10663.69478895 | 11493.0265945017 | 11326.1478205842 | 11162.2241715626 | 11894.4792266839 | 11507.5101021879 | 11487.7579540101 | 12036.2238954017 | 11776.7080872354 | 11181.2437259946 | 11392.8312780879 | 11589.8139296634 | 12254.5219970381 | M-CO2-H, M-H2O-H | |||||||||||
5.93_178.9684m/z | 178.968387313599 | 1 | 5.93435 | 0.25715 | 0 | 0.00406391624717006 | 1.8799439722725 | D6 MA_VO | Blank | 100 - 0.514 | 3046.71207604668 | 5.54 | 1085.263499095 | 1313.00535980224 | 1953.69451189206 | 2130.59594157951 | 1708.86350795079 | 1794.46618673902 | 1980.8418184104 | 2699.56837515328 | 3206.65144680005 | 3250.74480950467 | 3263.49384264514 | 3318.445748672 | 2709.00387270614 | 2983.13627314303 | 2467.34928723333 | 2306.43858315726 | 2925.17556712174 | 3182.07503425302 | 3153.01647889975 | 2314.87233365215 | 2928.67031334244 | 2927.88991965693 | 3043.66338081075 | 3286.6246903766 | 2524.22763697116 | 2157.14678512469 | 2995.39956647767 | 2840.30141192571 | 3101.71811692371 | 3083.89411534413 | 2873.85376353269 | 2564.14647248512 | 1910.3861703564 | 3017.94697077717 | 2708.3317067571 | 2027.04019782605 | 672.025411564066 | 880.397042951079 | 1408.84129563132 | 1438.39491507961 | 2034.41992724432 | 2083.85215176993 | 2245.59404678662 | 2699.56837515328 | 3045.44036272706 | 3010.50703958643 | 3028.9323479828 | 3014.09457532193 | 2854.40110917623 | 3089.58254126809 | 2785.62627335346 | 2416.67802043443 | 3008.08803158981 | 3101.32517600063 | 3052.99994365567 | 2600.62099483083 | 2931.25540051839 | 3089.00411568947 | 2881.70678639178 | 3007.99320105634 | 2917.37021426366 | 2577.68463924624 | 2977.55560743704 | 3114.8716757472 | 2863.65257569729 | 2931.90666533875 | 2955.37083435078 | 2749.62226938687 | 2376.20704232291 | 2903.67169377062 | 2811.12541015706 | 2445.16081239658 | |||||||||||||
13.03_447.2316m/z | 447.23160035196 | 1 | 13.0260333333333 | 0.891450000000001 | 2 | 0.00409099182282158 | 1.38448174170573 | Blank | D6 VO_MA | 100 - 11.1 - 2.4 | 1037.03423365069 | 4.24 | 957.650856792123 | 967.256824870518 | 1048.55501718361 | 1174.6742357565 | 682.001806110993 | 682.095813602028 | 673.415953908802 | 809.309638788118 | 925.441405361935 | 935.513382483746 | 905.971185651617 | 938.775596113002 | 754.011145147638 | 789.18509887632 | 719.017349504824 | 783.7397517732 | 832.286955866335 | 836.351235611491 | 826.466773365574 | 760.323318708346 | 794.835423270948 | 765.582311911101 | 861.788592372804 | 856.213817995921 | 706.888870712939 | 664.330948635409 | 827.975605477766 | 796.970439732049 | 876.185059533904 | 888.274655375668 | 888.578669806354 | 800.824377384244 | 664.362928690279 | 875.283957035733 | 837.468989537045 | 747.24730949603 | 593.0041061061 | 648.565553851596 | 756.130295682225 | 793.038893303515 | 811.930302398836 | 792.09451779688 | 763.422320275061 | 809.309638788118 | 878.915796115159 | 866.376719378281 | 840.855096676492 | 852.675814519843 | 794.480314600174 | 817.345330573271 | 811.767361087127 | 821.199682351082 | 855.877663867292 | 815.127586578119 | 800.250499610093 | 854.17789860264 | 795.537010899411 | 807.710322889991 | 815.931896652189 | 783.626238409082 | 816.985166475285 | 793.8429102192 | 823.043254229496 | 874.013102520008 | 808.935405455308 | 844.496693251994 | 913.78326833993 | 858.751465858928 | 826.358510288837 | 842.14112264594 | 869.254807611823 | 901.383130096796 | |||||||||||||
2.80_381.0993n | 381.099286863102 | 416.068688163102 | 1 | 2.79715 | 0.4343 | 0 | 0.0042503347868712 | 1.49928467437042 | D0 MA | D20 MA_VO | 100 - 6.29 | 837.452470275111 | 6.56 | 837.579716011376 | 706.830189712112 | 475.857864175993 | 487.474884246968 | 833.194921986175 | 795.785637658428 | 879.335912561275 | 840.60364263278 | 801.936021106706 | 726.668753487799 | 740.836683954766 | 764.271850093769 | 803.975176646294 | 790.193154014103 | 802.414946853227 | 953.226603586821 | 492.614652961373 | 689.196066385658 | 822.704648489178 | 739.547667987417 | 830.314451147378 | 610.405195236702 | 954.192889941655 | 725.879048442992 | 648.595309753581 | 544.184149905064 | 685.345832444516 | 629.862873784108 | 623.225393357874 | 541.753503806976 | 638.394595940712 | 430.898582347419 | 768.464528496674 | 835.400567090606 | 736.503831744154 | 692.540223935768 | 518.65270861836 | 473.944149767081 | 343.148944638638 | 329.101065596719 | 991.927292426133 | 924.118618470965 | 996.864803650952 | 840.60364263278 | 761.619517281882 | 672.966204983607 | 687.58952974893 | 694.176675439323 | 847.126007862403 | 818.38935581019 | 905.922874256793 | 998.787393778417 | 506.577539623351 | 671.706697319975 | 796.607712738371 | 830.83769419453 | 831.0473555067 | 643.994211553329 | 903.419262395307 | 664.340911482527 | 749.612519121557 | 650.273376760716 | 681.263144078107 | 690.751346641293 | 575.391101206614 | 515.053581405161 | 656.502705040603 | 462.067339203679 | 955.84382504637 | 803.767926709546 | 764.457555523393 | 835.391532142379 | x | x | M+Cl, M+FA-H | |||||||||
3.66_174.9459m/z | 174.945901080317 | 1 | 3.66001666666667 | 0.12 | 1 | 0.00439002505752406 | 2.93118182491966 | Blank | D20 MA_VO | 100 | 31.8291129764328 | 13.93 | 36.6043100516184 | 47.7084266829004 | 19.463651190332 | 23.5400639808804 | 17.0499355896889 | 22.5819003413524 | 25.161486482067 | 17.0816093528768 | 9.12524629885455 | 15.7565225330357 | 16.4383569112042 | 22.3632617674678 | 17.2224436514036 | 18.1368524318509 | 23.6056909127258 | 18.6215883136096 | 23.3698334096264 | 11.3380967701605 | 19.6095984674197 | 17.9224316926148 | 21.6391598844141 | 16.7116146964757 | 21.2800258079892 | 16.9842583193238 | 14.8885657442558 | 24.2756100290063 | 20.1945717644461 | 13.0701912458532 | 12.6739911680644 | 12.1989568980203 | 12.9607436787618 | 5.60150249091902 | 18.2413039976238 | 12.0145303250752 | 14.9484841267054 | 18.1852956210663 | 22.6664091697277 | 31.9894792979369 | 14.035559497041 | 15.892224175385 | 20.2981271239681 | 26.2235878085259 | 28.5244807168773 | 17.0816093528768 | 8.66648398162815 | 14.5920780574388 | 15.2568607133258 | 20.3122157434104 | 18.1468039808241 | 18.784023757642 | 26.6507191127705 | 19.511633004975 | 24.0322382594341 | 11.0503758028083 | 18.9875642632333 | 20.1347830118563 | 21.6582604005974 | 17.6312115529531 | 20.1476928007525 | 15.5443770927361 | 17.2074251938373 | 29.0081637056907 | 20.0742702475999 | 14.3336789318795 | 11.7012268957531 | 11.5977402925505 | 13.3283761149432 | 6.00668337644911 | 22.6891901191999 | 11.5595972880484 | 15.51584817586 | 21.9364037586265 | x | ||||||||||||
2.06_472.2588n | 472.258848258923 | 517.240729379757 | 1 | 2.05998333333333 | 0.165716666666667 | 0 | 0.00447032390583357 | 3.68207701727115 | D0 MA | Blank | 100 - 14.8 | 122.284989063405 | 8.79 | 19.4924802232763 | 25.5737727531438 | 35.1659063468546 | 52.6113292727705 | 66.724001846972 | 76.688723456091 | 79.1163950676643 | 75.238283362786 | 86.3995256195476 | 56.3912593618362 | 72.3671141330066 | 76.9273915483287 | 299.766812828034 | 81.4164311547659 | 47.8197291082759 | 60.1369831625439 | 81.1998173427248 | 90.856123157727 | 57.0993936507395 | 56.5788633214923 | 60.8481062265782 | 53.222357198125 | 61.6330670229791 | 65.9992093994389 | 55.2696908513652 | 79.4131765652936 | 96.1494341402164 | 56.9284079729118 | 96.5253208551113 | 102.505719893772 | 61.7358105881594 | 74.96654975405 | 58.0801878418478 | 31.3888879147489 | 47.72281018778 | 60.0376590575551 | 12.0702871287713 | 17.1477395281629 | 25.3587143528249 | 35.5186391866635 | 79.4356239403502 | 89.0559892247814 | 89.6908092892232 | 75.238283362786 | 82.0558788529435 | 52.2238112273784 | 67.1657749321703 | 69.8719976519952 | 315.855850798698 | 84.321586825497 | 53.9882595779644 | 63.0113138435325 | 83.5013807243944 | 88.5505147143766 | 55.288149226328 | 63.5629782595379 | 60.9018158088315 | 56.1510456140942 | 58.3535053928823 | 60.4039681591567 | 63.8778165169006 | 94.8948522176131 | 95.5766602826724 | 62.4316436261526 | 89.1167324904742 | 97.4538009902975 | 63.4869513412438 | 80.3892043121305 | 72.2422269961726 | 30.2003402377625 | 49.5341113602383 | 72.4217168228838 | M-H, M+FA-H | |||||||||||
2.51_396.2106m/z | 396.210633889036 | 1 | 2.51141666666667 | 0.0857166666666669 | 0 | 0.00464357000546434 | Infinity | D0 MA | Blank | 100 | 28.7343407824785 | 16.7 | 0 | 0 | 0 | 0 | 9.87623231840838 | 7.2057081092507 | 15.337185353056 | 4.70707171881769 | 7.63569232825863 | 9.59254817775463 | 0 | 2.94240939476377 | 26.8334015626917 | 24.1760834390567 | 35.4163872753717 | 28.5114908527937 | 0 | 0 | 2.79818740299794 | 0 | 33.3612525838577 | 0 | 43.4021572432707 | 0 | 0 | 0 | 32.2252957408651 | 0 | 0 | 5.41644426413997 | 0 | 16.1607642651749 | 2.90953800474179 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 11.7577581481382 | 8.36774215053624 | 17.3870986583492 | 4.70707171881769 | 7.25181579589812 | 8.88363606157773 | 0 | 2.67254638671821 | 28.2735997372371 | 25.0387506538052 | 39.9849423071193 | 29.8742371797487 | 0 | 0 | 2.70942636705526 | 0 | 33.3906999907014 | 0 | 41.0926818847689 | 0 | 0 | 0 | 32.033325740032 | 0 | 0 | 5.14949879811153 | 0 | 17.3297421932258 | 3.61898803710653 | 0 | 0 | 0 | x | x | |||||||||||
13.03_397.3246m/z | 397.324610181115 | 1 | 13.0260333333333 | 0.188566666666667 | 0 | 0.00469871184841519 | 1.70259426918171 | D20 MA_VO | Blank | 100 - 12.7 | 130.223658512001 | 6.19 | 112.921962951216 | 89.2794946678997 | 39.2799231401626 | 64.4603479758676 | 111.270984815138 | 117.546832033072 | 120.054671590518 | 132.613968936845 | 134.495861469163 | 141.590263378686 | 143.792555385524 | 109.125835140675 | 103.650776120197 | 119.030369312034 | 93.5968895671806 | 115.567959442518 | 98.1219133132022 | 130.033155943843 | 92.9086715405584 | 108.901234488614 | 99.5850776174747 | 141.718707862111 | 132.845302947751 | 72.9203316767822 | 122.414611713974 | 110.93615546539 | 128.840965627067 | 119.158136045629 | 123.521501771265 | 116.332587018494 | 156.4675289826 | 124.573016275644 | 113.760247605855 | 143.019128581852 | 131.982710994762 | 127.547523012956 | 69.9244272844288 | 59.863733620725 | 28.3253996324595 | 43.518076301231 | 132.469274332784 | 136.503111998443 | 136.100749341477 | 132.613968936845 | 127.734221175389 | 131.126406290681 | 133.457559108893 | 99.1173617518419 | 109.213904529757 | 123.277690737101 | 105.67046831657 | 121.091690665732 | 100.903124035239 | 126.733372375715 | 89.9615244248354 | 122.344041464812 | 99.6729796615839 | 149.517121158554 | 125.776461831608 | 66.7383356988659 | 141.480402470168 | 132.563266372083 | 128.073444345721 | 130.677082842316 | 114.040881010846 | 110.599221153079 | 160.905741811191 | 133.583920962297 | 141.499088347671 | 137.603675396564 | 136.992064765598 | 153.8569414282 | |||||||||||||
13.55_679.3700m/z | 679.369996211224 | 1 | 13.55175 | 0.285716666666668 | 2 | 0.00499704211034813 | 1.96059637852605 | Blank | D20 VO_MA | 100 - 23.8 | 205.118742021414 | 5.47 | 177.331719874953 | 158.153005615262 | 231.586642080438 | 253.403600515004 | 67.1942912786023 | 77.855799100665 | 96.092780020213 | 145.926736322716 | 130.804138962108 | 175.829745893209 | 156.376632395529 | 138.849999853095 | 114.825061649926 | 130.236593255411 | 93.6850066627586 | 106.019181229027 | 109.7913391098 | 139.17313646692 | 118.105938106577 | 97.5945202052551 | 143.632844008992 | 115.553309528676 | 108.241541092907 | 145.680164620715 | 95.2109191146971 | 99.3282759982144 | 112.583700965536 | 111.850940871043 | 133.349010748656 | 119.892082921534 | 118.390867743471 | 125.864604880688 | 91.9045782820306 | 134.03457838082 | 109.443765478649 | 83.0994218392028 | 109.808744265062 | 106.044836327609 | 167.000942518662 | 171.076290595687 | 79.9955084406802 | 90.4112742177203 | 108.936197099136 | 145.926736322716 | 124.228096198134 | 162.83550964459 | 145.137163778904 | 126.115375400711 | 120.987934582526 | 134.883782674872 | 105.769952122062 | 111.08651532785 | 112.903313175616 | 135.641412380822 | 114.359510899417 | 109.641622363598 | 143.759626262837 | 121.911908750122 | 102.481892545505 | 133.329779329829 | 110.039798086981 | 118.692419565045 | 111.913026184397 | 122.663505416023 | 123.114101185897 | 113.983289922316 | 121.749033309347 | 134.968935753544 | 114.314220613697 | 128.959327317353 | 113.597662115283 | 100.240463919733 | |||||||||||||
13.91_795.4652n | 795.465185751961 | 830.436425167537 | 1 | 13.90615 | 0.148683333333333 | 0 | 0.00511785004565513 | 2.74629882279569 | Blank | D0 MA | 100 - 41.7 - 27.6 - 2.06 | 847.095459649129 | 16.77 | 1179.56983284392 | 1070.59249967645 | 585.896857026334 | 552.322649049812 | 577.567848105466 | 552.988577363696 | 544.649080867402 | 439.435080431829 | 406.13689365647 | 421.981874486278 | 387.377645787733 | 323.086169166702 | 235.137072796562 | 315.583945029007 | 327.148566097015 | 355.929815644281 | 409.775627741891 | 449.636452800401 | 246.446397088281 | 362.649759540755 | 380.013001159342 | 256.826960830932 | 208.247195090572 | 664.691380247411 | 297.62558922318 | 522.841624703441 | 243.416385253029 | 293.584654847948 | 717.538913468226 | 912.515756642656 | 266.421610442169 | 852.553501206908 | 554.494525831166 | 202.610156326871 | 280.555216865268 | 358.562090900144 | 730.422522315112 | 717.854244755492 | 422.499875049506 | 372.880692379232 | 687.600580183503 | 642.166704148171 | 617.444927816161 | 439.435080431829 | 385.718781493474 | 390.796410719299 | 359.535129767815 | 293.454328803358 | 247.757313365703 | 326.844822894679 | 369.349263083713 | 372.941975809013 | 421.390488592263 | 438.226263085228 | 238.628894412635 | 407.415374369307 | 380.348432133431 | 270.959483039487 | 197.166138385416 | 608.340574583789 | 343.980081782258 | 624.770105609065 | 241.966324280569 | 321.965310435092 | 662.465794846072 | 867.543089698035 | 273.978678780673 | 914.222380787129 | 689.700238441167 | 194.938274758776 | 291.203583783474 | 432.523229889717 | M-H, M+Cl | |||||||||||
3.66_401.2417m/z | 401.241710140303 | 1 | 3.66001666666667 | 0.10285 | 0 | 0.00535806598548383 | 1.80501495672013 | D6 MA_VO | Blank | 100 - 5.33 | 37.5086387577268 | 2.87 | 11.8551337812559 | 20.0425411354848 | 21.5199078585458 | 29.7033655982015 | 25.6809963421879 | 22.0944470794421 | 26.6316220162737 | 43.2767643800348 | 34.346461315047 | 38.2112300890053 | 31.3136723868987 | 35.9602098664494 | 34.540433364179 | 48.0463881903817 | 29.852620358309 | 29.0085535124172 | 35.4181504807503 | 39.220121655151 | 33.3693018264163 | 24.6652924714508 | 39.4509253957609 | 35.0321381032265 | 33.7295823293998 | 41.8219092025202 | 33.005316097128 | 30.6597956751333 | 26.8782158615282 | 42.1579036315465 | 37.2285761003631 | 35.2075243808177 | 41.689596796838 | 35.1355066795372 | 28.564805624549 | 30.433622461917 | 30.1091952726115 | 30.2159558139984 | 7.34102931236441 | 13.4389352009682 | 15.5183600530969 | 20.0531547082219 | 30.5734954646477 | 25.6575250227095 | 30.1911093052384 | 43.2767643800348 | 32.6197285052821 | 35.3873293399908 | 29.063022576423 | 32.6621200690951 | 36.3942821564342 | 49.7608116197764 | 33.7034744244899 | 30.3950576399435 | 36.4220581354793 | 38.2248530866213 | 32.3107973832817 | 27.7099849146743 | 39.4857480526011 | 36.9598658937794 | 31.934795060977 | 38.2763565626234 | 38.1458172328924 | 36.6369525241422 | 26.7180990649961 | 46.2332833337404 | 34.3711787533689 | 33.4723474741211 | 42.8721252391648 | 37.6770097375189 | 35.529932817183 | 29.2812461376065 | 31.2519783669948 | 36.448646230466 | |||||||||||||
13.03_608.4413n | 608.441310546921 | 653.489995346473 | 1 | 13.0260333333333 | 0.200016666666667 | 0 | 0.00540800047373724 | 1.44292822441291 | D20 MA_VO | Blank | 100 - 31.7 - 43.4 - 9.37 - 18.7 | 544.94409810581 | 5.46 | 439.499244637093 | 424.218768586519 | 320.154863542945 | 326.788814884899 | 472.6763661312 | 509.965529918235 | 477.384781908703 | 478.681494426314 | 566.655710266046 | 511.082407394129 | 540.480346295957 | 507.345055403284 | 476.646952853147 | 444.648544035958 | 423.847789305747 | 472.376857439918 | 431.408456113929 | 511.929475290323 | 399.563025991106 | 443.4814194819 | 387.83692363016 | 590.108103487586 | 476.622040926631 | 399.295269362551 | 457.543747208416 | 420.468025958091 | 518.195701377372 | 517.304793123365 | 535.405577924509 | 516.131493795997 | 610.088178440552 | 518.151142262182 | 394.35286665718 | 518.500681499683 | 546.559410109438 | 435.669459323077 | 272.150183808481 | 284.447391352745 | 230.868945994885 | 220.619668169864 | 562.726170885286 | 592.205511980016 | 541.190323385331 | 478.681494426314 | 538.167680661426 | 473.312202412853 | 501.633673381739 | 460.813915646927 | 502.229474316105 | 460.514791436717 | 478.522252160246 | 494.954765790569 | 443.636487378379 | 498.938508037843 | 386.888525322079 | 498.224923057601 | 388.179260646746 | 622.580223435602 | 451.260470701695 | 365.444055408374 | 528.805120535832 | 502.438674679113 | 515.108746643891 | 567.312342648788 | 494.311702246775 | 490.694333285456 | 627.393373951294 | 555.631253893048 | 490.510281874685 | 498.867530360781 | 567.303865359537 | 525.535650569379 | M+Na-2H, M+Cl, M+FA-H | |||||||||||
15.54_810.4983m/z | 810.498255852193 | 1 | 15.5407666666667 | 0.131449999999999 | 35 | 0.00547387848988778 | 2.01168361911509 | Blank | D20 MA_VO | 100 - 11.4 | 84.2952467305189 | 16.69 | 100.733915181195 | 93.5966861442101 | 66.3711298423077 | 76.4792557543624 | 31.6655238379604 | 41.3816484890325 | 40.9035180317518 | 43.8069567651893 | 48.7916866725742 | 56.6935456473203 | 48.9028289549696 | 49.9740112105485 | 42.0021375048166 | 34.0201179934875 | 49.0155411773623 | 60.327193169061 | 68.6782383474251 | 29.7728646790996 | 37.2286304741722 | 41.6626209165071 | 42.9969834454036 | 40.221571197441 | 30.9219805450853 | 62.7238448762116 | 59.145027289079 | 60.8673981121852 | 32.6347168275824 | 64.1821211348968 | 32.4200665610216 | 39.3912258710066 | 48.913210823423 | 46.8868366780099 | 50.5162620310399 | 34.0677255742409 | 50.1725817975099 | 36.1025008437246 | 62.3772483498746 | 62.7584991151855 | 47.8613150573858 | 51.6322078904339 | 37.6981382087257 | 48.0550917509146 | 46.3705358656259 | 43.8069567651893 | 46.3387351021487 | 52.5037578376935 | 45.3879699707108 | 45.390645954381 | 44.2564697265482 | 35.2340466477643 | 55.3383260379002 | 63.2106152016408 | 70.6248845797787 | 29.0173342228012 | 36.0477046347969 | 46.8054696062682 | 43.0349361470112 | 42.4348600451995 | 29.2765887802319 | 57.4062805175781 | 68.3567275818324 | 72.733556300665 | 32.4403078556072 | 70.3865689652006 | 29.9317357709559 | 37.4498583179082 | 50.3006376024849 | 50.2783642254312 | 62.8339439703922 | 32.7777430746555 | 52.0768631228868 | 43.5494177112345 | |||||||||||||
13.55_724.5831m/z | 724.583081965032 | 1 | 13.55175 | 0.251433333333335 | 0 | 0.00551558939862029 | 2.03461670209538 | Blank | D0 VO | 100 - 8.41 | 144.718995868064 | 6.88 | 176.401845501087 | 198.395847402316 | 90.0225990648471 | 114.055691504005 | 78.2721937396483 | 79.1925369253418 | 103.821939040312 | 120.26086808879 | 112.410109847811 | 105.073773639575 | 84.3658557485934 | 50.5381387428751 | 82.6792032206664 | 70.6147325723411 | 94.2686777256492 | 85.9882469298663 | 72.8424820789429 | 77.1741364302365 | 66.1797739248206 | 68.3171392184683 | 80.1638066667248 | 89.1138808930054 | 97.5960137265086 | 60.6013750804895 | 83.830390868946 | 75.4959022560344 | 67.0601659818224 | 67.7792856323292 | 98.0891051357864 | 73.7613896025297 | 89.7237908738791 | 73.7860720642867 | 66.2875625057719 | 71.0242738880019 | 65.2332273956866 | 97.0530840470445 | 109.232940131484 | 133.028487723066 | 64.9167791231557 | 77.0005816183181 | 93.1838674956678 | 91.9635820922794 | 117.698407852608 | 120.26086808879 | 106.758807868167 | 97.3085719595597 | 78.3021148080504 | 45.9030345434232 | 87.116748616209 | 73.1344547937651 | 106.428914132912 | 90.0981746874144 | 74.907161469479 | 75.2157286270229 | 64.0804916230971 | 76.7502310928855 | 80.2345658872644 | 94.0175868619436 | 92.4028251131863 | 55.4637481883854 | 96.8867790642676 | 90.2139014894002 | 66.6606804278987 | 74.3314692349431 | 90.5604919535783 | 70.1261138455698 | 92.2688127213868 | 79.1233375689012 | 82.4508548526864 | 68.3349229314309 | 67.7091298163556 | 117.072368909395 | |||||||||||||
13.03_266.1622n | 266.162173516567 | 311.160376386567 | 1 | 13.0260333333333 | 1.19443333333333 | 1 | 0.00559381595824093 | 1.27502348082794 | Blank | D0 VO | 100 - 13.9 - 0.975 | 3684.87636841802 | 2.7 | 4362.75551319071 | 4166.44556077047 | 3048.83967487676 | 3161.46472483416 | 3349.2221278893 | 3269.10667333274 | 3145.92422066237 | 3098.11724732186 | 3137.58478157739 | 3135.64898453155 | 3141.10590328616 | 3137.71171336163 | 2874.43710552267 | 2814.57697710479 | 2721.92946755303 | 3257.13075047613 | 2754.54289195252 | 3195.64178630501 | 2740.80504885917 | 2869.19382660181 | 2716.59077574956 | 3046.17793069244 | 3141.60512903411 | 2767.61304069005 | 2888.67470871551 | 2871.07572113152 | 3040.84459875834 | 2864.51518668669 | 3237.79362630288 | 2927.61282471707 | 3306.22476060138 | 3105.17864967679 | 2693.23610338393 | 3008.89431516432 | 3336.78742096278 | 2978.4230452937 | 2701.53983041933 | 2793.68726405767 | 2198.56851292771 | 2134.34874987784 | 3987.28406689215 | 3796.30166671991 | 3566.39719330563 | 3098.11724732186 | 2979.84595264611 | 2903.91706971384 | 2915.34096206283 | 2849.93655778524 | 3028.71344885348 | 2915.00859944158 | 3073.04615453648 | 3412.80984104142 | 2832.61886873209 | 3114.54765166273 | 2653.86423310357 | 3223.36812930304 | 2718.98866394636 | 3213.80120948465 | 2974.43694909825 | 2532.98200854099 | 3338.57906888913 | 3430.79471249137 | 3022.72991814063 | 3141.42618184617 | 2989.28390911758 | 2783.32758300989 | 3400.00606616759 | 3329.78964236042 | 3349.94395102079 | 2894.96181910714 | 3463.43392279393 | 3592.78682332081 | M-H, M+FA-H | |||||||||||
3.66_697.5586m/z | 697.55861538104 | 1 | 3.66001666666667 | 0.188583333333333 | 32 | 0.00566475759586826 | 1.39245967727478 | D0 MA | Blank | 100 - 43.9 - 30.8 | 727.831625338806 | 2.47 | 482.846581839886 | 524.39501942526 | 534.156317042108 | 549.381835583405 | 566.730731141322 | 553.055025390824 | 569.166973124252 | 677.694130091899 | 677.658702268232 | 689.049977044688 | 727.723750385923 | 696.317296392292 | 832.28261698701 | 821.235157598017 | 662.465025022296 | 595.343701747902 | 811.042303255716 | 605.582292860529 | 632.310213579073 | 649.922458813739 | 724.742175410048 | 742.555010462148 | 740.285975105661 | 703.595984798672 | 661.116997242295 | 693.090785266542 | 656.099524488508 | 738.133549547223 | 648.287926395872 | 736.324108130043 | 762.560249294396 | 552.371498845601 | 651.219255430867 | 665.391769152419 | 618.996289977095 | 766.390972895615 | 298.992063359581 | 351.617623640019 | 385.188919347713 | 370.895308358862 | 674.69887878772 | 642.243867967324 | 645.239793806985 | 677.694130091899 | 643.590112077934 | 638.127545556548 | 675.419079740842 | 632.454572023284 | 876.95276075876 | 850.539020973757 | 747.920040518103 | 623.798981305943 | 834.030843467323 | 590.214746909456 | 612.252761553421 | 730.149117440302 | 725.381892927922 | 783.415888706696 | 700.894564025142 | 643.946947992543 | 764.084430282361 | 828.20950484434 | 652.191059930868 | 809.488484831104 | 598.530014732045 | 700.034916806857 | 784.190326173595 | 592.326916772608 | 810.009936662397 | 640.196552180735 | 642.49005954706 | 924.475585589577 | |||||||||||||
0.86_451.0691m/z | 451.069052888064 | 1 | 0.859966666666667 | 0.120016666666667 | 5 | 0.00568987874129134 | 6.20977589304799 | Blank | D6 VO_MA | 100 - 10.9 | 124.09052920265 | 23.99 | 156.754723160469 | 146.451900413838 | 81.8720227047632 | 111.283470531528 | 25.24891358681 | 31.0176784269663 | 25.0904898366143 | 17.2943477690609 | 33.2947370495322 | 24.148789598338 | 29.9200840074278 | 39.5896839444704 | 0.730376404967709 | 39.177971106755 | 19.7420384538838 | 36.0337176328641 | 42.2082415471016 | 24.1695190429217 | 27.6844992523942 | 15.0464114291677 | 18.9965553043817 | 24.3987489103755 | 18.8539530641093 | 38.8610126222347 | 13.2921097571632 | 29.5672531567301 | 12.3150092508805 | 24.7579998498571 | 21.4402449834397 | 47.4869284978885 | 22.5846970293217 | 37.5782307231892 | 52.002336006325 | 25.3784295765643 | 15.7170494989777 | 14.8089278682308 | 97.0668942928344 | 98.1990051269316 | 59.0392642458876 | 75.1290167324241 | 30.0590964130737 | 36.0197681129904 | 28.4439949138776 | 17.2943477690609 | 31.6208785891633 | 22.3641366343874 | 27.7695974541832 | 35.9587170178964 | 0.769577054304244 | 40.5759457331811 | 22.2886728244133 | 37.7559992422072 | 43.4046105332466 | 23.5561817659135 | 26.8063218899474 | 16.9037457879247 | 19.0133232387172 | 25.74134884506 | 17.8507139908105 | 35.5664770900424 | 15.3623249037877 | 35.331417784072 | 12.2416472449842 | 27.1513411065017 | 19.7946462108885 | 45.1465702037853 | 23.2253136015724 | 40.296426568993 | 64.6823762404115 | 24.4174693284437 | 16.3135841555302 | 17.8635875775133 | |||||||||||||
14.88_985.7880m/z | 985.787986058126 | 1 | 14.8836 | 0.200183333333333 | 14 | 0.00572679349713867 | 1.95980281378007 | Blank | D6 MA_VO | 100 - 59.3 - 21.1 - 0.933 | 379.792811687085 | 11.15 | 486.610194460559 | 453.197020793863 | 262.322533121752 | 317.041498372167 | 232.536180465015 | 259.770619067539 | 235.172247062398 | 213.722284211226 | 207.730539456709 | 206.996019687806 | 215.264629666367 | 177.296234917525 | 164.524762546125 | 247.903019188157 | 240.882041974676 | 278.799639591128 | 266.501180221441 | 163.825270712325 | 253.319311993794 | 149.239079960087 | 162.107725148147 | 224.28187948916 | 182.425640538081 | 206.350111291349 | 168.644733326246 | 204.560951190809 | 189.958418462023 | 286.275715746975 | 179.009724305198 | 229.942669280205 | 242.174191904393 | 225.177087298675 | 290.045330976284 | 233.40194385864 | 158.980498461805 | 171.43442754437 | 301.32259720918 | 303.87790423129 | 189.165099859255 | 214.039119397585 | 276.836761474651 | 301.662727061029 | 266.604527966068 | 213.722284211226 | 197.287101491444 | 191.698521709388 | 199.792624595399 | 161.035514925555 | 173.355110131125 | 256.748860890759 | 271.954744460237 | 292.125255805685 | 274.055007035861 | 159.667962274975 | 245.28379423942 | 167.661204875656 | 162.250814863467 | 236.62353019671 | 172.718576457829 | 188.856285787373 | 194.910757885839 | 244.440306663539 | 188.826813090776 | 313.949820498076 | 165.270227260323 | 218.610114191028 | 249.043480454244 | 241.465119265218 | 360.768816668175 | 224.564123961014 | 165.01454302307 | 206.796463423222 | |||||||||||||
16.11_530.4621m/z | 530.462106746949 | 1 | 16.1122 | 0.205716666666667 | 0 | 0.00573810579030454 | 15.1421418097359 | Blank | D6 MA_VO | 100 | 21.4626275020602 | 15.54 | 24.8727731945419 | 23.7742307717577 | 18.7301959374639 | 18.4733101044773 | 14.5077845041165 | 16.3465828397578 | 19.1330835025128 | 1.56008247372953 | 0 | 3.87739977239094 | 3.24116591814558 | 12.8807269009584 | 2.60407019675911 | 0 | 3.62652445312075 | 7.05712914730455 | 9.04570149160105 | 14.0396571836825 | 7.06328726049644 | 8.47485687687381 | 3.15294293670051 | 0 | 2.51669819379278 | 0 | 3.56816757513418 | 17.4101675473705 | 9.14680441793606 | 7.08530253286551 | 8.48713157200492 | 0 | 4.90054642580604 | 0 | 3.80408612877372 | 9.38534651158584 | 8.53471097707625 | 8.28026403788595 | 15.4019145182165 | 15.9411096943614 | 13.5066528320284 | 12.4715882539746 | 17.2716695967919 | 18.9827270507766 | 21.6903429696334 | 1.56008247372953 | 0 | 3.59085071087213 | 3.00820922851608 | 11.6993713378977 | 2.74383544921875 | 0 | 4.09432983398131 | 7.39443444200099 | 9.3020968382397 | 13.6833801269535 | 6.83923339843892 | 9.52099621295849 | 3.15572598548378 | 0 | 2.3827819824217 | 0 | 4.1239013671875 | 20.8042965657371 | 9.09231579304179 | 7.77023455364881 | 7.83572048467083 | 0 | 5.03955078124989 | 0 | 4.73165917397142 | 9.02996814251605 | 8.85864269732792 | 9.9882464903505 | x | ||||||||||||
13.06_885.4633m/z | 885.463346744143 | 1 | 13.0603166666667 | 0.10285 | 4 | 0.00574280310702779 | 2.53613738779583 | D20 MA_VO | Blank | 100 - 32.2 | 75.9923878055392 | 11.99 | 29.6987422203238 | 27.0742481985905 | 37.3939347350394 | 25.6883921032626 | 42.4336439900849 | 45.7644311803747 | 54.0824783494275 | 77.4776375193326 | 85.1266259340275 | 52.458174175318 | 98.4485829289367 | 94.8416594003942 | 84.5525055072757 | 57.171898807671 | 47.2763035579865 | 32.7832848190452 | 67.4511636316832 | 93.0823608041506 | 26.6445125933956 | 53.6348483474976 | 44.1497336650279 | 74.1455675291367 | 49.73186135706 | 59.7856541408521 | 53.4309762854933 | 54.297325420303 | 79.9496505812616 | 68.6776440924453 | 84.9815568929842 | 75.8060316571327 | 79.6414890545161 | 63.5404736175237 | 63.3202235346434 | 63.015316520722 | 64.4140806882595 | 84.9211374910774 | 18.3902890682231 | 18.1538391113291 | 26.9653823257383 | 17.3425903320323 | 50.5176981762231 | 53.1446672523011 | 61.3109488542607 | 77.4776375193326 | 80.846972882245 | 48.5813903868725 | 91.3726551433694 | 86.1432588517249 | 89.0905944931359 | 59.211944823835 | 53.3747345702445 | 34.3502074750135 | 69.3630291179127 | 90.7202582893374 | 25.7993245486479 | 60.2555530338936 | 44.1887038795307 | 78.2256059969876 | 47.0855756507345 | 54.7171819474717 | 61.752726438478 | 64.8826415769288 | 79.4733808020141 | 75.3166714780341 | 78.4589847012672 | 72.0699872225108 | 81.9005256783332 | 68.1366307037853 | 78.7599718942743 | 60.6292266322021 | 66.8588927061266 | 102.437947584868 | |||||||||||||
13.70_995.7836m/z | 995.783642205873 | 1 | 13.7003333333333 | 0.102966666666665 | 7 | 0.00612568324684459 | 2.57473505200307 | Blank | D0 MA | 100 - 43.3 | 73.7380901714059 | 8.26 | 91.3593923278817 | 93.8948687101778 | 57.2829910998995 | 52.4151085476645 | 46.7610802138118 | 32.2599549684241 | 44.5552616761665 | 45.1699218506172 | 52.0900558656068 | 37.9750865846987 | 51.2313571656206 | 25.6487756312288 | 12.8282676350121 | 20.8813325427256 | 47.3601449340242 | 33.4866479649388 | 20.4193035415022 | 26.8547000929918 | 32.9195325803615 | 56.5034821439602 | 45.4525648460842 | 59.2392443252094 | 43.2146273044848 | 14.6839877005648 | 59.6489603744741 | 38.7797084114736 | 37.1232473025736 | 69.4572723438114 | 60.8140211864395 | 66.6616787628076 | 59.670030191851 | 50.8032203675173 | 61.9881036327684 | 54.2282063858791 | 61.0592986410057 | 52.5962380577268 | 56.5722824738746 | 62.9584366458115 | 41.3077085018083 | 35.3861678495518 | 55.6695563828426 | 37.4623813330893 | 50.5103584966269 | 45.1699218506172 | 49.4712821963023 | 35.1686374020727 | 47.5491367326235 | 23.2963987808671 | 13.5167844295512 | 21.626434247486 | 53.4693911075629 | 35.0871888399097 | 20.9980772733686 | 26.173222377169 | 31.8752952246179 | 63.4782920027386 | 45.4926850473791 | 62.4990264498561 | 40.9151306152501 | 13.4391174316386 | 68.939147071969 | 46.3398501094238 | 36.9020996093792 | 76.1716659330578 | 56.1463749587213 | 63.3763070252289 | 61.3625749338936 | 54.478036874278 | 77.1030332390581 | 52.1748425043002 | 63.3767811778212 | 63.4453427791725 | x | x | |||||||||||
2.80_694.4268n | 694.426836540394 | 715.420102776472 | 1 | 2.79715 | 0.131433333333333 | 0 | 0.00615247317982393 | 2.17487516477315 | D6 VO_MA | Blank | 100 - 21.6 | 79.2126303253953 | 12.11 | 41.23915233099 | 24.9245136000053 | 33.3311471197367 | 46.1919493132265 | 41.2192853470057 | 53.6477569927438 | 39.7765025776835 | 63.2469349328239 | 48.9288050054205 | 59.5248207672887 | 75.6506776591947 | 70.0139103014921 | 74.3637059417161 | 68.0042613980514 | 59.0249100748925 | 33.3900165485272 | 68.7830058469175 | 62.0547115276141 | 51.6471162483941 | 66.0876420354847 | 85.6964778155981 | 84.9872169700705 | 81.7113556265037 | 56.07288882958 | 89.4998464654346 | 56.4586984664903 | 87.1609762101559 | 83.7310001595002 | 69.1282047759731 | 83.2319078762851 | 85.0690520753329 | 35.146908772969 | 52.3858050137411 | 77.5301985007868 | 78.026640219541 | 70.4531458370995 | 25.5364327104868 | 16.7123979400539 | 24.0356392502589 | 31.1848266079505 | 49.0719914765323 | 62.2993036442311 | 45.0928875593501 | 63.2469349328239 | 46.4689599526658 | 55.1257949950703 | 70.2133344682613 | 63.5925861741915 | 78.3549432546401 | 70.4308350372088 | 66.6388586073735 | 34.9859387906647 | 70.7326216554143 | 60.4799814832849 | 50.0088229958593 | 74.2455239875759 | 85.7721206302965 | 89.6638433156335 | 77.3634067153134 | 51.3191752185244 | 103.439239169701 | 67.4653763909233 | 86.6417476882449 | 91.8252266057857 | 63.8224217023247 | 79.1298846017968 | 87.4820419186046 | 37.6892365936499 | 65.1593487866296 | 74.5944991674853 | 80.9881117748945 | 84.985621644648 | M-CO2-H, M+Na-2H | |||||||||||
3.66_893.7843m/z | 893.78426392974 | 1 | 3.66001666666667 | 0.154283333333333 | 6 | 0.0067151404248641 | 1.59503947210635 | D0 MA | Blank | 100 - 55 - 32.7 - 11.1 - 0.63 | 1075.46257968472 | 5.67 | 741.236349078522 | 761.209900382747 | 599.522328757302 | 595.049516924876 | 920.931895292612 | 883.680079340697 | 888.770226116118 | 842.752030996681 | 780.481383357553 | 798.310695313849 | 829.222603433316 | 825.589042278071 | 1308.76451580259 | 1123.03745930955 | 992.940183004895 | 877.108160621842 | 1101.42563346699 | 669.80500282308 | 758.638756997248 | 952.276161113324 | 1065.74471806907 | 1040.47758440291 | 947.197701690984 | 775.273328625275 | 968.351440385374 | 1171.04963196437 | 854.721808257795 | 1034.84136608698 | 730.790120613892 | 933.284555516459 | 971.411891690719 | 722.818160174482 | 1171.16583256363 | 781.62625201207 | 862.317986161976 | 1391.06580375947 | 458.994210135263 | 510.406861905723 | 432.325427166379 | 401.726194376767 | 1096.37907925419 | 1026.18742466065 | 1007.56007379184 | 842.752030996681 | 741.243489249849 | 739.3136369833 | 769.622768824324 | 749.870162792743 | 1379.00832228255 | 1163.11043471613 | 1121.02501091296 | 919.030764052191 | 1132.64492666958 | 652.807710662305 | 734.574049284964 | 1069.8254678957 | 1066.68543269678 | 1097.73236996554 | 896.796295617463 | 709.547673116865 | 1119.16992261022 | 1399.346891424 | 849.630126630955 | 1134.87887115841 | 674.699934778627 | 887.288313616785 | 998.966060581742 | 775.102721806209 | 1456.73819369541 | 752.029788810709 | 895.046938485222 | 1678.0030284873 | |||||||||||||
0.83_284.9619m/z | 284.961913574208 | 1 | 0.825683333333333 | 0.13715 | 0 | 0.0067257459282567 | 1.69875843233935 | D6 MA_VO | QCs | 100 | 63.2948532730355 | 10.7 | 38.3577155992519 | 41.2690338933601 | 65.2570765319653 | 84.2053718924013 | 19.3300406737784 | 26.2619186714188 | 26.1734301695817 | 28.5570967920271 | 36.0967319471715 | 44.7077015663537 | 51.9923497189019 | 64.9565583976322 | 37.2000852905863 | 43.6309465812977 | 26.9169834501759 | 43.8761928418418 | 63.2657863773861 | 61.5537674773595 | 63.6513626935452 | 50.1851042844984 | 58.0865279654177 | 59.8800335558702 | 61.5661850497998 | 73.6466665210545 | 57.6139170128828 | 44.7270492461835 | 57.7166615024913 | 59.4357037063534 | 69.0792184935636 | 73.9274508604121 | 53.4101458838583 | 49.3970864014536 | 41.8254248636398 | 53.1467252521814 | 63.0687621919364 | 38.0976546196308 | 23.7521667629478 | 27.6717342651476 | 47.0579528635569 | 56.8482162143918 | 23.0126161382753 | 30.4970671152592 | 29.6716771761029 | 28.5570967920271 | 34.2820060921046 | 41.4036961301018 | 48.2554334417172 | 58.9990691805753 | 39.1966825092902 | 45.1878152634814 | 30.3891535285249 | 45.9733164522732 | 65.0590196875565 | 59.9917496288821 | 61.6322838835309 | 56.3799713412849 | 58.1377999497905 | 63.175076651577 | 58.2901822812618 | 67.4030937649933 | 66.5871504450067 | 53.4466307975574 | 57.3728363396189 | 65.1813181607028 | 63.7771952541087 | 70.2839908966713 | 54.9251285526587 | 52.9701911609703 | 52.0239680601263 | 51.1343119099351 | 65.4625131561871 | 45.9561148417517 | x | x | |||||||||||
13.70_1316.9613m/z | 1316.96125734366 | 1 | 13.7003333333333 | 0.102966666666665 | 0 | 0.00675051788933989 | 4.48283902234608 | Blank | D6 MA_VO | 100 - 80.2 - 92.3 - 52.6 - 59.4 | 910.623004495373 | 15.99 | 1534.41257144306 | 1426.18053178242 | 350.318305029155 | 331.580609726855 | 480.825573251276 | 483.424454449144 | 422.23181448177 | 265.585954360696 | 230.549607377458 | 199.509319691076 | 187.954168691459 | 192.672141614061 | 230.093045500506 | 145.152640368569 | 342.946948308595 | 159.899551012448 | 189.401020299478 | 107.66291013074 | 141.814743507613 | 422.127300181203 | 187.315054176633 | 268.25995079709 | 137.669071934876 | 219.297261253307 | 387.957106555432 | 358.574087426406 | 278.766858056176 | 238.439934406257 | 223.756371089929 | 480.718823076239 | 204.403023279199 | 359.457255393062 | 432.781665499703 | 295.274611312727 | 354.157940515775 | 396.44852388367 | 950.151037690839 | 956.283318664253 | 252.620300531362 | 223.854675427817 | 572.427887423316 | 561.38426963214 | 478.665807714551 | 265.585954360696 | 218.958964379756 | 184.7651066417 | 174.445085217732 | 175.001220703096 | 242.442563817488 | 150.3320741795 | 387.185565707249 | 167.542172261159 | 194.769486227575 | 104.930804621438 | 137.316251543781 | 474.234843703246 | 187.480393969988 | 283.02160082028 | 130.343552894905 | 200.705810064562 | 448.380522619902 | 428.47845291036 | 277.106210023538 | 261.489782362752 | 206.582443744393 | 457.026949958607 | 210.200929886528 | 385.458352292776 | 538.309404300586 | 284.093968204186 | 367.599870912739 | 478.224554092444 | |||||||||||||
4.20_873.1688m/z | 873.16884339066 | 1 | 4.19716666666667 | 0.365733333333334 | 5 | 0.00677052472795669 | Infinity | Blank | D0 VO | 100 - 70.1 - 53.2 - 21.6 - 6.58 | 1279.3379621397 | 86.25 | 30.7210256889506 | 207.028891595531 | 617.993191210954 | 4261.60874006338 | 0 | 0 | 0 | 0 | 25.5492635817624 | 45.2100582697594 | 210.10076352531 | 390.884382947659 | 89.9591993644438 | 151.417249165994 | 10.8018648402678 | 36.5685899539217 | 0 | 0 | 0 | 0 | 0 | 0 | 50.5481825031037 | 748.525931012193 | 0 | 0 | 0 | 0 | 0 | 129.092098628276 | 0 | 0 | 25.1650980957929 | 29.1673246236048 | 0 | 0 | 19.023315489283 | 138.817121046328 | 445.645070351244 | 2877.07125604568 | 0 | 0 | 0 | 0 | 24.2648007869698 | 41.8689274787959 | 194.999907970378 | 355.034431010989 | 94.787475585986 | 156.820220947266 | 12.1952569325939 | 38.3164365291473 | 0 | 0 | 0 | 0 | 0 | 0 | 47.8584594726644 | 685.067850275613 | 0 | 0 | 0 | 0 | 0 | 122.729889631303 | 0 | 0 | 31.3012542929026 | 28.0628969669306 | 0 | 0 | |||||||||||||
0.98_330.9421m/z | 330.942072058873 | 1 | 0.979966666666667 | 0.2743 | 2 | 0.00698803456663755 | 2.33245012171951 | D20 MA_VO | D0 MA | 100 - 14.6 - 15.6 - 0.335 | 1417.50598481852 | 6.4 | 1516.37119080291 | 1384.20051644705 | 898.531360631218 | 954.398938085856 | 842.39398173654 | 780.373863837132 | 779.785823158972 | 710.951393324491 | 727.769408684546 | 694.198612199253 | 766.033158664072 | 795.725554773552 | 550.388544242952 | 693.624442449485 | 631.283976552304 | 555.633450432891 | 1037.81925317315 | 839.32092612037 | 475.219921110038 | 649.012624971129 | 261.898654184804 | 652.598395656761 | 378.113934047828 | 1188.72834703354 | 517.310830174584 | 1581.18538191907 | 730.393035263744 | 558.334617793716 | 1486.97788329946 | 1671.68978882317 | 842.220015843207 | 1669.13625130823 | 928.926429851495 | 445.125017306229 | 615.422257090116 | 649.286636825369 | 938.979311874951 | 928.134856749469 | 647.945765610565 | 644.327980124825 | 1002.87886953044 | 906.221453131527 | 884.009205570797 | 710.951393324491 | 691.181554570786 | 642.895684332548 | 710.975024247149 | 722.745604338356 | 579.928912982914 | 718.374814748528 | 712.716776716684 | 582.19072334507 | 1067.23565912161 | 818.021916800058 | 460.145515281061 | 729.126973385746 | 262.129827645759 | 688.509194468719 | 357.994085891547 | 1087.95105089109 | 597.880787518126 | 1889.43900289006 | 726.041995238679 | 612.308496292883 | 1372.8481715607 | 1589.30178887885 | 866.109647788677 | 1789.87209057133 | 1155.43211035767 | 428.270253074864 | 638.78037559651 | 783.215962900409 | x | ||||||||||||
13.36_746.5494n | 746.549364359755 | 727.531523239755 | 1 | 13.3631833333333 | 0.217149999999998 | 1 | 0.00706281652242713 | 1.67684134107062 | Blank | D20 VO_MA | 100 - 49.2 - 9.93 | 448.457877985109 | 8.93 | 567.152330222898 | 412.436123368694 | 396.880781242158 | 417.362277106688 | 293.41257172567 | 302.747818111388 | 279.03651966145 | 342.538730381855 | 351.878539900288 | 338.242266890899 | 360.497028768611 | 323.749703962976 | 245.583491753329 | 312.537721408921 | 278.080818237096 | 321.114229245759 | 326.554920001493 | 338.938983919676 | 275.610191529592 | 328.007143479362 | 326.719911939841 | 291.821927223039 | 216.442300589385 | 467.952824414747 | 293.954867498192 | 355.303749158206 | 278.611044113473 | 283.260061458161 | 395.337873046233 | 528.658046987928 | 256.818576732693 | 444.777848248463 | 309.306776855649 | 242.626444485422 | 257.807294282376 | 260.027665780717 | 351.196532874639 | 276.546885897476 | 286.197269149756 | 281.767070621215 | 349.310743687491 | 351.570677049944 | 316.331542258458 | 342.538730381855 | 334.188210339851 | 313.245359212273 | 334.586539591539 | 294.057007521486 | 258.764410903489 | 323.689901881466 | 313.951995935478 | 336.462330076297 | 335.810936462802 | 330.337906128263 | 266.867586909788 | 368.496461505121 | 327.008302015923 | 307.880131759197 | 204.925173527086 | 428.281001592969 | 339.737653695154 | 424.570559030718 | 276.951324283416 | 310.64264468616 | 364.994585498429 | 502.603524529866 | 264.103254322266 | 476.950552395188 | 384.726895958149 | 233.43933668626 | 267.592272421018 | 313.663961468478 | M-H2O-H, M-H | |||||||||||
0.88_390.2250m/z | 390.225019486477 | 1 | 0.8771 | 0.188566666666667 | 0 | 0.00715827271317526 | 11.9572788451009 | D0 VO | Blank | 100 - 17.6 | 27.1906312988594 | 19.27 | 0 | 3.60003096691684 | 5.49589517183001 | 0 | 26.0148146217869 | 26.9058344083567 | 23.3805462035365 | 16.8827208876592 | 23.8149957101282 | 29.3383957905915 | 19.1729817973374 | 18.5111759317737 | 39.8808735158376 | 15.3613627816512 | 25.1165133306357 | 13.7844076442993 | 13.2418164249944 | 0 | 58.6158668771346 | 36.9048418933087 | 25.8709837189035 | 7.40944850548403 | 37.4174295873415 | 31.4148443201055 | 11.1967424907156 | 37.9748313186073 | 18.4217310191701 | 2.20225516492468 | 5.16655155560894 | 20.1633687345852 | 18.5155646120198 | 8.24362320706206 | 13.514988109139 | 37.7663032113747 | 16.5825056627068 | 31.3771485732479 | 0 | 2.41389465331906 | 3.96318054199597 | 0 | 30.9709096272973 | 31.2448244170643 | 26.5055063343798 | 16.8827208876592 | 22.6177214384095 | 27.170218590984 | 17.7949362166317 | 16.8134238690257 | 42.0213535851495 | 15.9094972253047 | 28.356430842957 | 14.4432525634762 | 13.617148301197 | 0 | 56.7565185500289 | 41.4603886544497 | 25.8938195935789 | 7.81717125864868 | 35.4264080091724 | 28.7515755613377 | 12.94060906424 | 45.3780614480914 | 18.3119905299739 | 2.41514587402222 | 4.77000427245991 | 19.1696319580079 | 19.0407599475889 | 8.83992010355166 | 16.8104283940955 | 36.3362731933583 | 17.2118883799226 | 37.849359957604 | |||||||||||||
1.33_353.2046m/z | 353.204608611018 | 1 | 1.33425 | 0.21715 | 2 | 0.00733353345795695 | 489.901339821877 | D6 MA_VO | Blank | 100 - 15.3 - 0.937 | 371.869521944158 | 8.39 | 0 | 3.03628091386209 | 0 | 0 | 62.5812731573739 | 56.0570928941573 | 63.298318239199 | 54.0593913059549 | 51.9847409036484 | 56.8469529852657 | 51.7887007695774 | 62.5785979146219 | 46.9853505340966 | 0 | 0 | 0 | 0 | 0.509675979453919 | 13.7759127576027 | 115.389531374363 | 1356.38182135888 | 60.5758622030352 | 68.6233227536793 | 1.8970814610394 | 123.191242198948 | 0 | 34.2888792118355 | 14.4883647326682 | 0 | 0 | 38.6462582352957 | 0 | 0 | 0 | 75.9600013045312 | 6.10766975548292 | 0 | 2.03588867187534 | 0 | 0 | 74.5036619901581 | 65.0971829464992 | 71.7585449218846 | 54.0593913059549 | 49.3712618351037 | 52.6458280086459 | 48.0664216280035 | 56.8392032870196 | 49.5071409940756 | 0 | 0 | 0 | 0 | 0.49674219798977 | 13.338928341866 | 129.633256017372 | 1357.57907638486 | 63.9091949462837 | 64.9718021154347 | 1.73625183105489 | 142.377991344945 | 0 | 34.0846161936218 | 15.8889464139953 | 0 | 0 | 39.742462158194 | 0 | 0 | 0 | 78.8430343631768 | 7.36750793456551 | x | ||||||||||||
0.86_438.1580n | 438.15797307577 | 459.13264089577 | 1 | 0.859966666666667 | 0.120016666666667 | 1 | 0.00756115288471315 | 1.69401015227046 | QCs | Blank | 100 - 20.4 | 101.981978856848 | 9.13 | 42.9626657444803 | 45.7332400407353 | 71.2225384571395 | 80.8876187441331 | 66.9025222289421 | 77.6849029225463 | 100.974760414108 | 107.707805168873 | 118.1077446051 | 96.9576695116451 | 116.956107914458 | 130.564318089111 | 78.1964141376714 | 102.575843731126 | 80.0413334962797 | 57.8763634731667 | 83.5739021632712 | 97.0092884145291 | 113.974173165804 | 79.7631289489525 | 103.961981545909 | 83.8730737250417 | 110.726336173969 | 90.6780582277864 | 79.2588854932324 | 66.9715146285272 | 69.7617907037922 | 80.5190731878957 | 85.7757921994638 | 103.490516848673 | 74.102510752567 | 72.5003370418186 | 57.961702673076 | 88.8534281032458 | 80.1673861722652 | 41.2498841207202 | 26.6036802609691 | 30.6650761140073 | 51.3597457265376 | 54.6083549789384 | 79.6481543272473 | 90.2128183364484 | 114.470685520759 | 107.707805168873 | 112.169999932475 | 89.7922672223474 | 108.54996382317 | 118.589614743735 | 82.3933599715402 | 106.236023744778 | 90.366306341449 | 60.6426446945797 | 85.9427576505977 | 94.5475343061828 | 110.358809280573 | 89.6091178517734 | 104.053747008227 | 88.4883916546076 | 104.834469014057 | 82.990608399196 | 91.6032723701343 | 80.0276762413415 | 69.3462112432587 | 88.3028045464888 | 79.1922602264351 | 98.3900629526376 | 76.2044338543846 | 77.7445997751579 | 72.0948508809059 | 85.4889719985499 | 83.2101089288544 | 49.7585594385636 | x | M+Na-2H, M+FA-H | ||||||||||
16.47_1095.8420m/z | 1095.84200902594 | 1 | 16.4665 | 0.32 | 2 | 0.00794049763731097 | 2.084014152603 | Blank | D0 MA | 100 - 63.5 - 25.2 - 1.63 | 6704.15577872187 | 5.45 | 4634.96293478865 | 4908.89105957954 | 8272.96450870076 | 8999.80461181854 | 2123.22358655374 | 2360.34652536992 | 2623.57318270298 | 3720.71232928816 | 4262.69438184784 | 4537.57082719148 | 4594.36322516274 | 4606.51045630916 | 3351.26860443847 | 3453.91939562708 | 3418.81899072743 | 2643.76700267665 | 4588.10564083523 | 3320.71353123467 | 3132.89869366625 | 3575.19972049162 | 3572.25890919359 | 3837.31872430425 | 3483.69792861975 | 3899.98614552562 | 4272.15411977992 | 2924.94312192708 | 4464.53380455105 | 5341.49162048884 | 3269.36379167153 | 4347.62156990757 | 4785.63651679008 | 3587.22333222354 | 2528.49001320937 | 4072.82093839262 | 3400.00019016959 | 3155.18346779673 | 2870.09825395674 | 3291.5122095722 | 5965.7709873292 | 6075.89310470238 | 2527.71994625826 | 2740.98961694737 | 2974.23058501192 | 3720.71232928816 | 4048.39183173586 | 4202.23355519668 | 4264.14636033103 | 4184.02445876403 | 3531.13737415994 | 3577.16446269936 | 3859.83129899251 | 2770.1295205409 | 4718.15292763648 | 3236.44551616351 | 3033.52031277033 | 4016.52364091928 | 3575.41208101128 | 4048.4764311006 | 3298.32662374392 | 3569.35546802905 | 4937.53217706811 | 3495.16361522174 | 4437.93803441225 | 5857.85046792663 | 3018.43097598992 | 4133.35224311362 | 4921.38144431529 | 3846.70270025039 | 3145.02683753744 | 3918.60260870043 | 3529.04590869666 | 3806.00788265185 | |||||||||||||
2.81_174.9461m/z | 174.946134375338 | 1 | 2.81428333333333 | 0.165716666666667 | 2 | 0.00822770900791181 | 2.00582896809617 | Blank | D0 VO | 100 | 45.9391355572225 | 10.69 | 64.3829154376931 | 55.0188474440183 | 31.3202602732594 | 33.034519073919 | 34.7975890987088 | 35.4122349221776 | 32.2586737358149 | 30.5793515056608 | 18.8827841160983 | 28.5812430068175 | 29.4849573524074 | 27.3987944191294 | 29.8726961502091 | 32.5738587706335 | 28.0247772775645 | 35.7782927752736 | 25.2237971691168 | 18.6923749548247 | 22.9470890699093 | 24.7480103311099 | 22.7487336490031 | 15.8508755730621 | 28.8494772610744 | 27.0953289722234 | 24.1465557107915 | 29.5268788609898 | 36.7606778579822 | 28.9354784661766 | 29.4372287854476 | 31.4442053215668 | 31.6121664677014 | 19.0530684815743 | 31.4082723708612 | 29.7787916780083 | 18.6099685848229 | 23.7531843001204 | 39.8676959842385 | 36.8912664633645 | 22.5855556200318 | 22.3020626908729 | 41.42689474794 | 41.1230161297514 | 36.5702526194191 | 30.5793515056608 | 17.9334716796904 | 26.4690211980268 | 27.3657452441258 | 24.8859146370276 | 31.476018873337 | 33.7361810338781 | 31.6398477885552 | 37.4883659985911 | 25.938751584175 | 18.2180283062527 | 22.2191866443849 | 27.8029134962421 | 22.7688135669635 | 16.7231081857775 | 27.3143656198105 | 24.7982574850961 | 27.9073255422589 | 35.2831724802901 | 36.5416900350071 | 31.7326541190495 | 27.1778391378919 | 29.8945008227996 | 32.5088478665117 | 20.4312592744812 | 39.066739046228 | 28.6512106764614 | 19.3163028887851 | 28.6527891664792 | |||||||||||||
14.12_721.4236m/z | 721.423585836285 | 1 | 14.1234166666667 | 0.337266666666666 | 57 | 0.00838679746835191 | 2.03989571356492 | Blank | QCs | 100 - 18.8 | 237.672554133404 | 6.01 | 159.565208070796 | 168.234502848369 | 304.801092972254 | 318.089412642199 | 65.7218259857433 | 75.3288735718218 | 82.2990972548173 | 125.169594059975 | 129.693970179305 | 166.525019920173 | 138.077457762784 | 149.281042700751 | 113.544834649379 | 148.300870030255 | 107.928133107591 | 127.519671725187 | 149.518386740294 | 112.811419231113 | 150.501550388205 | 88.4269171379259 | 118.185062677769 | 128.597852418207 | 132.917489796926 | 135.913717136042 | 137.854916476382 | 99.9864600319573 | 114.051872511946 | 133.87458785339 | 155.55014238517 | 141.360545384765 | 115.437081735576 | 137.873642281474 | 112.201655008617 | 123.581101985916 | 154.261181173733 | 108.715045347233 | 98.8072248946944 | 112.804687143362 | 219.797089114513 | 214.746580877275 | 78.2425230676352 | 87.4768421066247 | 93.2989000603989 | 125.169594059975 | 123.173740002371 | 154.218425042518 | 128.153230405957 | 135.589735400314 | 119.6389954366 | 153.592641082265 | 121.850377963963 | 133.614651645922 | 153.756401739211 | 109.948662692029 | 145.727505051168 | 99.3423671249479 | 118.289382610445 | 135.674259036082 | 125.84480754108 | 124.391305850217 | 159.325498749618 | 119.478917213363 | 113.37245165458 | 146.81616537455 | 143.611233870976 | 134.393695025831 | 118.711462946715 | 147.846638734021 | 139.560454806905 | 118.901674282593 | 160.116105836077 | 131.139860416218 | |||||||||||||
2.04_133.9970m/z | 133.996959235094 | 1 | 2.04283333333333 | 0.10285 | 0 | 0.00854612945287325 | 3.3141530034018 | D20 MA_VO | Blank | 100 | 19.7846049593388 | 14.35 | 8.51229588777198 | 11.3619996665898 | 0 | 4.00463211014978 | 11.3366081283157 | 16.3673389115949 | 13.8970973016741 | 14.9075930118536 | 15.405041819514 | 7.70514647441254 | 16.0432580778864 | 18.3254892789833 | 10.508513816884 | 17.9277111976873 | 11.7392292534817 | 15.6007020200102 | 30.2528726973515 | 18.9851113638089 | 8.67578952584756 | 16.5900378449656 | 6.92172447594775 | 30.1055842587837 | 5.35616364779107 | 10.3646082886737 | 16.4777430966526 | 16.2168507178092 | 22.3179431070834 | 15.1498803902552 | 18.1895254280808 | 19.4824286274087 | 23.8745691237484 | 17.5918966581173 | 18.511603316097 | 14.5000835863898 | 18.1314679985001 | 21.5479786327223 | 5.27105090340308 | 7.61845397948977 | 0 | 2.70358276367205 | 13.4963508649455 | 19.0068303664477 | 15.7545335918328 | 14.9075930118536 | 14.6305692791973 | 7.13571783132311 | 14.8901593513533 | 16.6447674632041 | 11.0725251436218 | 18.5674198057714 | 13.2535371488024 | 16.3463592529291 | 31.1103734438944 | 18.5033360960886 | 8.40058563310263 | 18.6379179954979 | 6.92783416371175 | 31.7622165561182 | 5.07115643279614 | 9.48592376708835 | 19.0441132187842 | 19.3783414649875 | 22.1849924092431 | 16.6144104003981 | 16.7934284739248 | 18.5222514824611 | 24.5517730116803 | 18.8643945776746 | 23.0253981351799 | 13.9510344862905 | 18.8196409940729 | 25.9927124265214 | |||||||||||||
5.93_150.9731m/z | 150.973124705817 | 1 | 5.93435 | 0.10285 | 0 | 0.0085742502535171 | 2.54003295544965 | D0 VO | Blank | 100 | 16.5927608214842 | 11.32 | 3.96838792403658 | 6.34281590685563 | 2.58185579034813 | 13.2369333552436 | 6.96528512579664 | 11.2822647010711 | 13.6453502212375 | 19.1905941654523 | 20.2327535478519 | 11.9802229589408 | 17.8216740350302 | 11.2814339557415 | 11.217712969696 | 15.7166427805842 | 14.6330772571523 | 7.57638432757844 | 15.6161890303137 | 19.082217183122 | 21.6493395233697 | 10.0232975491315 | 19.1127754531364 | 11.2514038444528 | 9.18481677037848 | 15.2543009910378 | 11.2653377880547 | 9.71969978455749 | 13.3761668730819 | 16.4909666644083 | 13.5177474761127 | 13.7444037389656 | 12.8351012814706 | 16.4738470252129 | 9.33194874940895 | 14.133035273542 | 7.79312775377748 | 8.74646850131372 | 2.45733642578088 | 4.25298825072568 | 1.86181874119338 | 8.93643757497953 | 8.29224498792866 | 13.1017077657448 | 15.4691388975821 | 19.1905941654523 | 19.2155727948624 | 11.0948559998476 | 16.5407528197313 | 10.2467575073243 | 11.8197883235711 | 16.2774545633074 | 16.5206785591519 | 7.93850814521092 | 16.0588211692716 | 18.5979777116791 | 20.9626028875352 | 11.2605769505149 | 19.1296459730087 | 11.8705394453051 | 8.69608281449125 | 13.9610810453234 | 13.019887919429 | 11.6145646673231 | 13.2964834223413 | 18.0851386944282 | 12.4802225471051 | 13.0670209242522 | 13.1991698619236 | 17.6654715824784 | 11.6074135591157 | 13.5978845447632 | 8.08891296386868 | 10.5506156460093 | |||||||||||||
2.80_312.1876n | 312.187609657182 | 311.160446570722 | 1 | 2.79715 | 0.485733333333334 | 0 | 0.008994898937009 | 1.27297642429473 | Blank | D20 VO_MA | 100 - 9.38 - 2.42 | 1307.87044102456 | 2.96 | 1592.58580465561 | 1431.86809082227 | 1036.54344212342 | 1170.48442649694 | 1021.89891582907 | 1048.82312658267 | 1043.55673073489 | 1094.05654681929 | 1139.81163069372 | 1160.54896256561 | 1157.32271689284 | 1164.68481785402 | 1083.12894176911 | 1076.82365694848 | 1047.0982775662 | 1007.6983760017 | 1097.16145166396 | 1062.84890941074 | 1020.7890996947 | 1055.18340431508 | 1120.45058703343 | 1123.15155464062 | 1151.11375925612 | 1062.03976589213 | 1039.47588432335 | 1008.68719904897 | 1097.82915460217 | 1042.56194628986 | 1065.48415641344 | 1156.25801949738 | 1077.65569110511 | 968.606538687305 | 963.708098950109 | 1102.22062849961 | 1043.03474806129 | 1000.68196980559 | 986.173525339483 | 960.096943736622 | 747.468551040282 | 790.210294874085 | 1216.58137605446 | 1217.96239199531 | 1183.03478866522 | 1094.05654681929 | 1082.50878014334 | 1074.78163508038 | 1074.14090029685 | 1057.86577733219 | 1141.26247065059 | 1115.24760048163 | 1182.16925664474 | 1055.86272025381 | 1128.25987901967 | 1035.8775470592 | 988.408745944693 | 1185.43561766513 | 1121.43958959566 | 1184.95567457482 | 1089.86176095258 | 972.002798010059 | 1201.37183309231 | 1205.33174502659 | 1091.28925298519 | 1143.34579530009 | 983.705267164692 | 1099.27269465848 | 1108.22347308625 | 1038.67003606355 | 1198.69480160739 | 1060.48478328306 | 1082.62273658595 | 1207.09413699078 | M-H2O-H, M-H | |||||||||||
16.99_719.4693m/z | 719.469318916457 | 1 | 16.9865166666667 | 1.85718333333333 | 45 | 0.00910018272660729 | 2.21905294359259 | D0 MA | Blank | 100 - 32.7 - 17.7 | 2128.26658132043 | 9.61 | 379.62575495815 | 224.367785850792 | 1916.43720266767 | 1315.92041248062 | 921.258059614957 | 1456.09019729049 | 1690.55234924331 | 2377.14679718953 | 2135.22464323703 | 2484.47514742926 | 2362.08482080909 | 2329.10117854391 | 2000.79537183345 | 2535.91667991075 | 1508.86618871098 | 2467.48808482656 | 1592.86819472606 | 1848.49082001622 | 2406.70247278613 | 1926.4752240211 | 2105.80354589243 | 1935.21487921533 | 2376.91810634189 | 1965.82982682257 | 2114.9442897596 | 2646.61166505644 | 1440.492758057 | 1495.39126920378 | 2300.21821361726 | 2011.59162328805 | 1557.95482170935 | 2301.48237981981 | 1544.66678440055 | 1420.28109887159 | 1486.90586503052 | 2168.67187609965 | 235.074849959308 | 150.44320552223 | 1381.97443621194 | 888.396149181792 | 1096.76738130046 | 1690.90769902381 | 1916.50552606385 | 2377.14679718953 | 2027.87843327739 | 2300.86652730917 | 2192.31151256864 | 2115.48771904271 | 2108.18175128374 | 2626.40495873422 | 1703.50315619927 | 2585.42510684213 | 1638.01715230726 | 1801.58263272007 | 2330.35969300611 | 2164.28000835209 | 2107.66230265203 | 2041.70473982167 | 2250.43974341157 | 1799.17188927297 | 2444.34193865937 | 3162.57117137791 | 1431.9115677341 | 1639.94986202694 | 2123.67003182866 | 1912.45181178981 | 1602.14632342882 | 2467.95854763354 | 1921.3121137964 | 1366.5018185952 | 1543.34081356075 | 2616.0070688645 | |||||||||||||
11.80_727.4980m/z | 727.497976507422 | 1 | 11.7973166666667 | 0.302866666666667 | 23 | 0.00925623127142305 | 2.26606961264622 | D20 MA_VO | D20 VO_MA | 100 - 32.2 - 1.43 | 372.674467609145 | 12.3 | 259.514787322186 | 244.57069866113 | 310.857828732009 | 345.12004070533 | 185.845462462008 | 169.578116192035 | 171.748387517499 | 242.461770773359 | 220.153562013056 | 270.243133813518 | 269.870860167779 | 264.931867815254 | 123.87889047686 | 262.947986349068 | 149.16356941634 | 136.585134153319 | 306.633112509662 | 264.179583076384 | 162.053896224756 | 189.594132775348 | 283.766237426654 | 234.732187000392 | 127.682607977483 | 406.663063085992 | 169.313344828259 | 224.736058735741 | 183.096517941613 | 200.473169493237 | 379.49560921619 | 509.754098163163 | 191.394146830571 | 410.054016226658 | 216.547923274414 | 131.880620620896 | 140.788969417796 | 168.616589451199 | 160.698790572599 | 163.989673222788 | 224.164701043159 | 232.995333350066 | 221.250972041667 | 196.925261078356 | 194.703662336853 | 242.461770773359 | 209.085569440906 | 250.271523734113 | 250.474067840615 | 240.633647824867 | 130.527699108619 | 272.330672654701 | 168.405000517483 | 143.113410448834 | 315.324456486224 | 257.475635602813 | 156.91340002638 | 212.997699710902 | 284.016713029181 | 247.648891053241 | 120.888479400407 | 372.187226751238 | 195.683504072559 | 268.548570956137 | 182.005789745216 | 219.852792657797 | 350.368259729415 | 484.63124289906 | 196.823055712203 | 439.714995522701 | 269.350096995869 | 126.886929678285 | 146.132561389271 | 203.397385650373 | x | x | |||||||||||
2.01_390.1798m/z | 390.179832299946 | 1 | 2.00855 | 0.320016666666667 | 0 | 0.0101059873871355 | 1.4778936841096 | D20 MA_VO | Blank | 100 - 33.9 | 109.223352509743 | 8.65 | 66.4970122261937 | 79.299126419294 | 68.3296470361286 | 81.4931852474017 | 114.297525664935 | 121.252456123317 | 123.219598999535 | 107.311488406626 | 109.507536624992 | 71.7549983925317 | 98.8063152693855 | 86.8021178913352 | 63.8138539715764 | 68.3965405307199 | 94.4179927328389 | 100.200582415267 | 106.109079810564 | 84.7141330809756 | 95.1011081754945 | 111.118964028303 | 86.6679998556233 | 102.476276568989 | 93.4840821214141 | 84.9688990870008 | 102.233824036437 | 117.584129865037 | 95.3880682849919 | 80.1208196650743 | 109.265152469011 | 111.935025019656 | 94.1835985757008 | 121.509633974606 | 100.757953405197 | 88.0067054923464 | 107.652620460839 | 114.882811336715 | 41.1768036484722 | 53.171691864735 | 49.2736340683999 | 55.0171813368814 | 136.072402954115 | 140.806326397896 | 139.688689621284 | 107.311488406626 | 104.002158511292 | 66.4521334171247 | 91.7046757048136 | 78.8410637020143 | 67.2388612628008 | 70.8371117368379 | 106.597490105996 | 104.989808497837 | 109.116682297203 | 82.5643867159063 | 92.0844149862143 | 124.835528324769 | 86.7445002162037 | 108.115280549629 | 88.5096938010032 | 77.765456914904 | 118.156504098834 | 140.507269816932 | 94.8198299763234 | 87.8660520902901 | 100.878746393684 | 106.41838975829 | 96.8551231927224 | 130.298950979121 | 125.326367080435 | 84.6743107399026 | 111.738534867214 | 138.579860724889 | |||||||||||||
13.70_1298.0352m/z | 1298.03518766087 | 1 | 13.7003333333333 | 0.102966666666665 | 0 | 0.0102954078936531 | 2.56148126114758 | Blank | D0 MA | 100 - 77.3 - 60.5 - 20.3 - 1.13 | 365.891080157678 | 21.49 | 262.522341777497 | 314.26270390847 | 435.601429960432 | 451.177844984314 | 99.1285837556437 | 118.51688938355 | 158.767877001069 | 169.618807424292 | 212.549541242896 | 216.928340468822 | 230.136447837322 | 206.392998948331 | 145.740321031309 | 147.416377986283 | 214.729005327814 | 63.4885012090051 | 149.273499802875 | 115.294472214364 | 108.692458003247 | 250.522704244441 | 152.36320661097 | 260.233003004825 | 106.033424162727 | 187.048914595577 | 254.691311820573 | 162.082020106001 | 274.590795782967 | 223.35240365931799 | 182.646129674465 | 426.188916239207 | 188.663283799688 | 175.182166494222 | 161.408674671608 | 261.491988823887 | 227.612111621467 | 180.601280795543 | 162.561152130246 | 210.719593157258 | 314.119366783694 | 304.596430208584 | 118.013618532836 | 137.629606391078 | 179.988223239684 | 169.618807424292 | 201.863832948289 | 200.896820371052 | 213.595540520258 | 187.463669931485 | 153.562472979379 | 152.676588000296 | 242.428083444534 | 66.5230223525381 | 153.504573618594 | 112.36870453498 | 105.244634901339 | 281.44731563317 | 152.497695006506 | 274.552950889057 | 100.391271886544 | 171.191394324976 | 294.358890638184 | 193.68006683935 | 272.955025060517 | 244.943748908949 | 168.627528346184 | 405.184509415556 | 194.014731553024 | 187.853849754969 | 200.765916021643 | 251.590532719061 | 236.251043046994 | 217.854177210445 | |||||||||||||
2.04_163.9826n | 163.982643949654 | 162.973511194316 | 1 | 2.04283333333333 | 0.371433333333334 | 0 | 0.0110982359098185 | 1.73938859376973 | D20 MA_VO | Blank | 100 - 0.97 - 0.455 | 13470.6206726952 | 7.05 | 5665.74916259848 | 4353.61155657751 | 10043.9732726011 | 10914.4951625482 | 8451.4430452022 | 9047.63886108442 | 9451.08998898453 | 12177.0174996117 | 12874.1492334103 | 13877.6843551399 | 13801.3543551435 | 14143.7222301491 | 9767.27271024602 | 11206.9835295853 | 9219.84938879849 | 9861.2637367304 | 12752.7556638221 | 12886.2656463729 | 11203.4426013758 | 10688.9188506615 | 10184.2216182862 | 14201.0269112339 | 12995.2061743989 | 11488.7523656667 | 11599.5767513918 | 9905.28083705703 | 13109.4893239566 | 11262.19655003 | 13661.6050861467 | 13977.1489263754 | 14162.7347090358 | 12080.993969223 | 8105.70342354561 | 12565.3573538176 | 12591.4724825379 | 10455.7111737409 | 3508.38982052664 | 2919.18590579537 | 7242.87458071105 | 7368.52729139795 | 10061.5315764733 | 10506.7132768716 | 10714.2888531805 | 12177.0174996117 | 12226.9146995458 | 12852.0904877406 | 12809.3909986926 | 12846.5310803447 | 10291.5002590612 | 11606.8786280437 | 10409.168586989 | 10332.5965409583 | 13114.2253864367 | 12559.2576050331 | 10848.0592663079 | 12008.3627813794 | 10193.2110564563 | 14982.4726268938 | 12303.7173096817 | 10514.765834302 | 13406.1838230963 | 11836.3249256708 | 13031.394503767 | 12350.9064541858 | 12613.0386831879 | 13288.2954365311 | 14564.4617081281 | 12954.8644785138 | 10082.1655102417 | 12089.5671208554 | 13069.3770481085 | 12612.4263619375 | M-CO2-H, M-H | |||||||||||
2.06_318.0155m/z | 318.015469389776 | 1 | 2.05998333333333 | 0.320016666666667 | 1 | 0.011442774317567 | 1.32654119761286 | D20 MA_VO | Blank | 100 - 4.61 | 91.1797624773118 | 2.25 | 67.9691991303016 | 55.1433442379924 | 69.1144761370904 | 82.7128395548301 | 91.4454991765784 | 80.4490980632627 | 88.8298189314795 | 88.6605870069849 | 85.5425082829741 | 90.6505984989285 | 83.9404645858381 | 89.4134484884281 | 63.8996691839604 | 77.7298312539672 | 82.0410902621869 | 96.588423345726 | 82.1004850126305 | 83.859066274447 | 85.2401709289585 | 78.164752851011 | 83.4957231177899 | 79.8493324599113 | 102.988913713156 | 84.4326019631456 | 82.9633364416794 | 72.589172794489 | 76.6405173181045 | 74.6897541508112 | 115.144275899636 | 87.6322150012723 | 79.1701547092021 | 82.7724042991369 | 88.5693136443724 | 88.4863219035132 | 85.1307818811863 | 89.7226974071462 | 42.0884228183396 | 36.9747441189989 | 49.8395872615515 | 55.8405869013637 | 108.866825768154 | 93.4227835252389 | 100.702494624099 | 88.6605870069849 | 81.241947176346 | 83.951303752241 | 77.9072983580916 | 81.2128961751592 | 67.3292823359786 | 80.5034391958724 | 92.6240227564904 | 101.205001265848 | 84.4275773153735 | 81.7310184936915 | 82.5362755903264 | 87.8134376418914 | 83.5694233639716 | 84.2432343332853 | 97.5087631048289 | 77.2746256657426 | 95.8846829287193 | 86.7405023052844 | 76.1839604476351 | 81.9099686730602 | 106.306630656632 | 83.3133258312139 | 81.415821900067 | 88.7596900542979 | 110.165698475613 | 85.1357663620385 | 88.3618884406482 | 108.229932449172 | |||||||||||||
13.08_751.3733m/z | 751.373293289044 | 1 | 13.07745 | 0.137133333333335 | 14 | 0.0114608012446422 | 3.94091979174831 | Blank | D6 MA_VO | 100 - 64.1 | 92.357227207176 | 13 | 161.453716502013 | 142.736254379299 | 25.1169461963953 | 40.1219917509972 | 82.8545230759108 | 68.3918813296645 | 64.3984298562848 | 64.0208238542337 | 51.2183064412892 | 46.5911516818236 | 49.5755384649537 | 43.4793008026057 | 24.7659108954183 | 32.6878888460857 | 40.9510418844094 | 37.3148589157424 | 55.9484058756404 | 26.6464649153719 | 18.0353543542192 | 53.4687693328963 | 26.8370291869608 | 6.5652156484953 | 23.3678748995235 | 36.9716787157864 | 50.7163157758993 | 63.9848248820227 | 48.1780923244344 | 58.0430567588105 | 39.4451920367512 | 66.8271970370587 | 37.8799966278163 | 65.6205071591512 | 78.4493184745248 | 51.0132466150216 | 45.3897597228202 | 68.7783896379492 | 99.9766419595723 | 95.7075881977929 | 18.1122436523417 | 27.0869139432963 | 98.6391786258515 | 79.4211504934546 | 73.0056935206107 | 64.0208238542337 | 48.6433590724311 | 43.1479548042227 | 46.012328922752 | 39.4915977578868 | 26.0951430309417 | 33.8542800069181 | 46.2335425246264 | 39.0983744530679 | 57.5342321304294 | 25.9702714750282 | 17.4632565975219 | 60.0689731668771 | 26.8607177734417 | 6.92648245497124 | 22.1244452018125 | 33.8373159960598 | 58.6152638750658 | 76.4587284373032 | 47.8910895767164 | 63.6540448533688 | 36.417663216588 | 63.5336678532474 | 38.9544654845415 | 70.3671220616318 | 97.5780844298205 | 49.081617946797 | 47.1125108491694 | 82.9654109784401 | x | x | |||||||||||
2.80_638.3377m/z | 638.337698731681 | 1 | 2.79715 | 0.131433333333333 | 0 | 0.0115192742086419 | 3.36907421967826 | D6 MA_VO | Blank | 100 - 16.7 | 58.3820326258646 | 8.92 | 33.9114277269372 | 28.0501437978038 | 0 | 7.35365137520461 | 69.6262203729987 | 66.0281075565666 | 62.0509494908986 | 37.4998780488981 | 39.2249877333708 | 28.8339637753012 | 36.537300361409 | 11.8662685188873 | 57.2367038301284 | 62.8549153465481 | 47.040977895372 | 56.4649599908827 | 34.4053836320263 | 32.5888411636721 | 35.1575795416427 | 51.0730287385014 | 61.2812347741974 | 60.0112492272409 | 79.6849634742736 | 32.5506830277466 | 42.8595067773085 | 48.7225468619579 | 39.2961930068193 | 44.4613470779213 | 31.1172036445388 | 30.0471555376824 | 47.3170271567339 | 18.9975190095986 | 63.4198325788259 | 52.6126745457471 | 43.6627829144584 | 66.8007009343327 | 20.9989013672017 | 18.8081971406868 | 0 | 4.96455218886832 | 82.8907455314518 | 76.6761809310475 | 70.3444573307922 | 37.4998780488981 | 37.2529920549641 | 26.7030653008875 | 33.9112056920369 | 10.7779539823439 | 60.3087033371814 | 65.0977465682364 | 53.1090529531482 | 59.1637812214708 | 35.3805849771912 | 31.7618511410456 | 34.0423493115266 | 57.3775015045404 | 61.3353266716088 | 63.3135127813598 | 75.4448410638723 | 29.791120818843 | 49.5347751679734 | 58.2210545416196 | 39.0621008121373 | 48.7593993007546 | 28.7288712275245 | 28.5663036085046 | 48.6591780701107 | 20.371691669106 | 78.883869206733 | 50.6204831600177 | 45.3199872906165 | 80.5797814668059 | x | ||||||||||||
15.34_796.7432m/z | 796.743235310702 | 1 | 15.33505 | 0.239983333333333 | 0 | 0.0120772123380838 | 3.34960171540442 | Blank | D0 VO | 100 - 39.8 | 145.521717517349 | 28.5 | 181.863162551184 | 189.648469758576 | 89.8611665345247 | 120.71407122511 | 101.921471302943 | 83.8694326471958 | 49.3541223040106 | 65.4509515035325 | 54.4667281909299 | 41.4542456738544 | 36.0260269470093 | 41.7629485582193 | 63.3916535223919 | 48.1778395770861 | 134.410640418619 | 68.5115497541061 | 28.5244254093209 | 47.6828966328238 | 33.5306256298092 | 64.0399875949309 | 78.305341162511 | 49.9863359771548 | 74.3156246900089 | 43.063934357443 | 87.4749707746646 | 74.3967253440164 | 64.0753326041232 | 142.275750493697 | 38.2194909717839 | 34.1956192473233 | 125.479742643005 | 70.5795659424926 | 45.8395258971157 | 79.1101712905243 | 64.5025564265813 | 155.765549434708 | 112.614739889178 | 127.163191474554 | 64.8003674662707 | 81.4957462558732 | 121.338580447198 | 97.3947009874757 | 55.9506176617394 | 65.4509515035325 | 51.7284697792366 | 38.3906783629995 | 33.4366797213418 | 37.9326607189983 | 66.7940005364692 | 49.8969535429745 | 151.749009881049 | 71.7861544832466 | 29.3329342847555 | 46.4728726381923 | 32.4670038496814 | 71.9451063572604 | 78.3744599473484 | 52.7369545299572 | 70.3612105577515 | 39.4130860567114 | 101.098993804617 | 88.9004389742571 | 63.6936280651702 | 156.029463456847 | 35.2860381367404 | 32.5103133398033 | 129.038984660487 | 75.6848910004159 | 57.0168513275768 | 76.1146459132405 | 66.9507265075617 | 187.895542381274 | |||||||||||||
0.83_165.9697m/z | 165.969713508726 | 1 | 0.825683333333333 | 0.13715 | 1 | 0.012143505427884 | 1.77160700343859 | D20 MA_VO | D20 VO_MA | 100 - 7.62 - 7.74 - 0.383 | 38539.8097453202 | 10.15 | 46253.42992402 | 24852.9561822914 | 35800.0716841387 | 38165.5529245452 | 22160.0428983536 | 21677.2767550343 | 21844.5321690324 | 25034.4068342382 | 25941.9064659761 | 26349.5389840561 | 27112.2749523538 | 27906.0645632362 | 25410.8064184248 | 30197.0232833533 | 20693.9862174003 | 13073.72330423 | 38475.7080221258 | 33703.3728435237 | 20628.7860780606 | 21634.4472968895 | 17043.4029847225 | 30790.8197263292 | 20271.2768905049 | 34626.704643147 | 23374.2630509942 | 33445.4258308696 | 30071.5127908618 | 24621.5452067811 | 41384.6351932828 | 43148.5720160457 | 32818.1391414603 | 36807.892630492 | 26360.4420774932 | 19977.2351517498 | 25986.2383742948 | 14692.6962534182 | 28641.4131746436 | 16664.4172227733 | 25816.0214241124 | 25766.0949157585 | 26381.763465159 | 25173.0794061824 | 24764.1941611386 | 25034.4068342382 | 24637.7039563851 | 24402.2454083208 | 25163.5978464194 | 25346.6605118658 | 26774.6512866216 | 31274.5337095236 | 23363.4175776724 | 13698.6000777545 | 39566.2804342997 | 32848.0999318399 | 19974.4223208059 | 24305.0111377358 | 17058.4469049239 | 32485.1587559781 | 19192.6204955801 | 31691.1427235817 | 27014.7500988292 | 39965.6439755436 | 29892.3731366618 | 27001.6954734865 | 38208.2486860788 | 41022.0264256954 | 33749.0280427883 | 39470.3665925579 | 32788.0661382713 | 19220.7924100792 | 26972.5362023133 | 17723.3806936014 | x | ||||||||||||
13.06_798.5220n | 798.521975213415 | 779.504134093415 | 1 | 13.0603166666667 | 0.251433333333333 | 0 | 0.0130419983795718 | 1.44585319214456 | D6 VO_MA | Blank | 100 - 57 | 180.094461197415 | 4.82 | 155.852131775024 | 144.925782431197 | 93.7664922424437 | 103.692792669155 | 198.947670791173 | 178.82731924022 | 178.57440684258 | 178.705386169713 | 181.769615089712 | 168.578790845738 | 155.873448666369 | 178.279081346754 | 147.108473710364 | 147.923640705342 | 126.543007012958 | 160.348664561379 | 131.426050685327 | 140.494618646709 | 193.228018715893 | 146.799537512761 | 155.137709158351 | 195.700167183956 | 148.187551550763 | 92.0234977672672 | 176.674971578725 | 177.536034893561 | 192.822723798722 | 173.344114518653 | 168.70460159071 | 178.429746914878 | 156.230517386029 | 154.109563990331 | 200.252029694058 | 162.821708225247 | 152.083122022247 | 174.874142358287 | 96.5079845462303 | 97.1757116962679 | 67.6165621664742 | 70.0044446696653 | 236.849288461756 | 207.666043945457 | 202.442022975843 | 178.705386169713 | 172.631335739337 | 156.120417413938 | 144.670146052591 | 161.928219617774 | 155.004056937218 | 153.20195120772 | 142.866487071116 | 168.012751816281 | 135.151248543569 | 136.929359996669 | 187.098651148875 | 164.920524444141 | 155.274646559814 | 206.469040319381 | 140.302332923841 | 84.2219850754074 | 204.191687049316 | 212.146856770975 | 191.674055412683 | 190.101187924824 | 155.756051538421 | 169.635968262179 | 160.662007363462 | 165.25697483367 | 249.080678337252 | 156.656425670489 | 157.855379275039 | 210.945693358489 | M-H2O-H, M-H | |||||||||||
16.55_667.5157m/z | 667.515724848401 | 1 | 16.5522166666667 | 0.200000000000003 | 16 | 0.0131104669220604 | 2.51135406529995 | Blank | D0 MA | 100 - 24.3 | 128.500639851483 | 10.96 | 141.412868543238 | 138.672677554867 | 111.54555903563 | 122.371454272197 | 66.8004549266154 | 67.0349626927932 | 62.4447093698139 | 40.2311593152556 | 51.7438432317128 | 47.3612095462618 | 61.1568698953323 | 53.8005776265277 | 48.3654684811898 | 39.8420056829306 | 48.4037166311216 | 68.0602916165945 | 62.6264815178387 | 39.3790766755236 | 85.8884422129175 | 68.8365786068581 | 69.4443673532923 | 20.1829617435417 | 58.7925702415452 | 64.3366787451111 | 63.9141338648302 | 77.2889322714233 | 55.7751551962078 | 82.6752468941915 | 15.2493486170296 | 66.843625073814 | 72.2182326181345 | 68.4731757568448 | 45.3567148772051 | 45.4188573286947 | 42.0993849957985 | 81.6457298761376 | 87.5667902426211 | 92.9828765328133 | 80.4373401046638 | 82.6146685727444 | 79.526642133437 | 77.8454073325542 | 70.7908457459283 | 40.2311593152556 | 49.1424750444059 | 43.8611035617019 | 56.7612596986566 | 48.8662589220263 | 50.9613324179666 | 41.263674836213 | 54.6475788706835 | 71.3133278359514 | 64.401594089532 | 38.379774388359 | 83.1639831226673 | 77.33379026345 | 69.5056647081598 | 21.29357783366 | 55.6641544931116 | 58.8823825277311 | 73.8686114028336 | 92.3564844421446 | 55.4428958222186 | 90.6674142944303 | 14.0789184570305 | 63.5492862463115 | 74.2667080337565 | 73.4261365085705 | 56.4163136125196 | 43.6990615361196 | 43.6972511965235 | 98.4869167403558 | |||||||||||||
0.83_181.9648m/z | 181.964847011833 | 1 | 0.825683333333333 | 0.13715 | 0 | 0.0131433563272302 | 1.69669902568792 | Blank | D20 VO_MA | 100 | 28.5463503084538 | 7.73 | 39.2658332291505 | 20.7864111892994 | 31.7949837638466 | 22.3381730515189 | 27.1981986253233 | 31.0035498325933 | 20.5472372440892 | 22.754976351517 | 23.3787922644955 | 24.6294901415398 | 25.4736493924864 | 25.0506869661615 | 24.3644569079644 | 26.0785353945332 | 22.7141940165684 | 21.9458857714786 | 22.0880926869482 | 25.3221227321149 | 29.1565303355127 | 16.4017962160993 | 10.5099170281982 | 19.6993206818144 | 25.7993636415765 | 17.4379511245026 | 23.2874615420377 | 17.3787957772435 | 24.8002558715258 | 21.2928906983897 | 13.3462104891616 | 12.4005298089342 | 26.1059387567794 | 15.8898879283029 | 22.2853861883305 | 15.9539814181515 | 16.091864581816 | 12.967327842123 | 24.3144985141678 | 13.9377153398526 | 22.9278865491891 | 15.0808109141768 | 32.3797406937782 | 36.0033610600165 | 23.29350743931 | 22.754976351517 | 22.2034476697352 | 22.8093122646033 | 23.6427474315491 | 22.7531638035702 | 25.672142267223 | 27.00908717519 | 25.6442231174938 | 22.9948198795288 | 22.7141673132572 | 24.6795364325282 | 28.2316588153631 | 18.4264397532578 | 10.5191939521339 | 20.7833232574336 | 24.4265518188535 | 15.9596070024187 | 26.9144294569529 | 20.7668088386524 | 24.6525177350445 | 23.3512618952041 | 12.3218515037052 | 11.7893788310203 | 26.8464356064844 | 17.0392722001481 | 27.7193650285468 | 15.349880132221 | 16.7026252027726 | 15.6421179585207 | x | ||||||||||||
16.04_695.5467m/z | 695.546659363276 | 1 | 16.0436333333333 | 0.137133333333335 | 15 | 0.0133614714197419 | 7.65001244318272 | Blank | D6 MA_VO | 100 - 27 | 119.033863062313 | 24.62 | 150.587307565687 | 137.025861076177 | 98.1868564650495 | 90.3354271423389 | 31.801401565335 | 28.2724409462477 | 21.4196570359103 | 15.8323059082068 | 29.7094533307947 | 28.292250039469 | 32.7532256505404 | 46.3314062758344 | 24.2117057064463 | 27.1136344375332 | 53.1218235011981 | 33.4340980582743 | 30.5022993863636 | 16.4024423373456 | 24.4521718587396 | 37.691332217558 | 30.6010323263468 | 0 | 23.4781011787697 | 8.16069365667577 | 63.5750148394809 | 34.9941167277773 | 10.8776653075468 | 60.9446138451944 | 2.90794644107628 | 36.1909629481623 | 60.5504695767634 | 41.9985323636764 | 21.0796073833449 | 22.2555853251896 | 15.5307574812814 | 30.0246941865236 | 93.2478586329912 | 91.8786522832332 | 70.8041596238203 | 60.9867016628014 | 37.859902068129 | 32.831817805768 | 24.2825317382742 | 15.8323059082068 | 28.2158413002596 | 26.2013854980327 | 30.3991088867175 | 42.0821224450976 | 25.5111926268648 | 28.0811213160798 | 59.9743003550631 | 35.032127237429 | 31.3668699928229 | 15.986206114291 | 23.6765268455054 | 42.34396362303 | 30.6280433339967 | 0 | 22.2288062224645 | 7.46885128291652 | 73.4766753788579 | 41.8162536621111 | 10.8128657341016 | 66.8360937535287 | 2.68475341796596 | 34.4073179960344 | 62.2679880459321 | 45.0364677322076 | 26.2195739745967 | 21.4128723144557 | 16.1202214949118 | 36.2179327809162 | |||||||||||||
0.83_133.9974m/z | 133.997444777668 | 1 | 0.825683333333333 | 0.13715 | 0 | 0.0136140521509325 | 1.82089314160206 | D20 MA_VO | D20 VO_MA | 100 | 1244.59513260061 | 10.12 | 1417.771533061 | 739.841503206614 | 1108.60447592722 | 1181.85721830978 | 685.419115487319 | 678.517446298431 | 657.086840957175 | 766.223353302439 | 805.793437065235 | 788.967092864526 | 823.565519178695 | 867.330031290709 | 802.404659624392 | 941.39925552338 | 650.928900121669 | 383.373386253386 | 1210.94760025259 | 1053.28365228937 | 619.759126239444 | 684.854016667653 | 511.120683358559 | 965.567205729114 | 619.045766437182 | 1062.72452760561 | 731.851966755449 | 1096.54064351458 | 930.245389744562 | 761.519881960841 | 1328.85002772288 | 1386.42790887134 | 1055.65929365036 | 1207.44330015784 | 856.837646928434 | 600.717622809838 | 812.914264223964 | 463.562692674813 | 877.923655226275 | 496.078913016538 | 799.432949573786 | 797.888224600038 | 815.99864504903 | 787.939082347314 | 744.910716525244 | 766.223353302439 | 765.283005643754 | 730.660548968965 | 764.372283816454 | 787.782877985364 | 845.471198294037 | 974.990894788518 | 734.895807272266 | 401.697250012966 | 1245.27123231322 | 1026.5550224782 | 600.099806059171 | 769.392639174268 | 511.571840840469 | 1018.69986724825 | 586.105676953653 | 972.629507407253 | 845.836206604775 | 1310.31230354282 | 924.703804969663 | 835.135560218571 | 1226.85707119582 | 1318.0988305683 | 1085.60314621943 | 1294.78289277222 | 1065.76548885867 | 577.971307710859 | 843.768117006382 | 559.182462899911 | x | ||||||||||||
0.83_102.0253m/z | 102.025327933091 | 1 | 0.825683333333333 | 0.0685833333333333 | 0 | 0.0136839127020026 | 1.74749279734173 | Blank | D20 VO_MA | 100 | 17.8578034496965 | 10 | 23.2448265974748 | 10.0066715357679 | 19.3243676904881 | 18.8553479750554 | 11.6422893120995 | 11.0583788285225 | 9.35338039084037 | 10.9939346313485 | 12.5366720673994 | 9.84271860376811 | 11.7217133859871 | 13.8562697056594 | 12.480668337949 | 14.1440817274114 | 10.4409356893704 | 5.73578919700519 | 21.3703399674393 | 18.085346205238 | 12.6422023583095 | 11.2966207357518 | 6.91520267902158 | 12.1045462042611 | 9.66006840959123 | 15.2767850186134 | 12.1833271138783 | 15.4964813621896 | 14.1429478859812 | 13.448223633029 | 18.8195530543124 | 19.7322272060195 | 16.1631327300332 | 14.6067274078687 | 12.6039396067352 | 9.10588728246544 | 12.8584097154805 | 6.30816294754977 | 14.3938446044945 | 6.70967864990262 | 13.9351198708938 | 12.7295073270767 | 13.8602675199504 | 12.841716766355 | 10.6035197398332 | 10.9939346313485 | 11.9064038489218 | 9.11531829834016 | 10.8792228698744 | 12.5854422573396 | 13.1505288368286 | 14.6487803325316 | 11.7877695408568 | 6.00993921254678 | 21.9760702945814 | 17.6264038085948 | 12.241180262106 | 12.6910796025143 | 6.92130661010702 | 12.7706280186576 | 9.14604580402473 | 13.9816589355455 | 14.0808519453927 | 18.5175354060909 | 14.058696627613 | 14.7482554871651 | 17.3750997176057 | 18.7597389221165 | 16.6216011643409 | 15.6632951332979 | 15.6772334930322 | 8.76109070331078 | 13.346445782551 | 7.60935715734852 | x | ||||||||||||
2.87_473.2675m/z | 473.267451664575 | 1 | 2.86571666666667 | 0.33715 | 20 | 0.0144744540626672 | 1.48026057164662 | Blank | D20 VO_MA | 100 - 24 - 4.5 | 453.705250212515 | 8.34 | 442.60213723078 | 405.133508072458 | 443.49742252699 | 523.587933019831 | 308.611874746674 | 296.375984580462 | 347.087841605735 | 383.13581935206 | 399.838989052811 | 430.846439142001 | 453.715693153663 | 460.624694338389 | 281.498053139527 | 400.6988016514 | 339.987548567226 | 316.951797675015 | 466.061464691798 | 345.108228056676 | 310.289088102182 | 313.995149424709 | 404.481921539404 | 416.280835244798 | 289.899194571685 | 477.178565697242 | 293.2101813725 | 355.658992326621 | 341.405880127599 | 345.773920343498 | 458.037846593196 | 534.896102198874 | 349.501208106054 | 444.39174653134 | 366.216280776781 | 271.162554786999 | 300.462201650462 | 288.173514285484 | 274.071581399067 | 271.650332456457 | 319.813297093705 | 353.481486449487 | 367.405673330664 | 344.171284900756 | 393.478360350515 | 383.13581935206 | 379.737497528319 | 399.005862971871 | 421.105173180497 | 418.378511392047 | 296.606573068409 | 414.996804884432 | 383.844416679193 | 332.100949304211 | 479.271716091927 | 336.350596574912 | 300.446437509105 | 352.754821938983 | 404.838950810849 | 439.187691012817 | 274.473347359525 | 436.724608535285 | 338.876984439241 | 424.995057198731 | 339.372083832306 | 379.199681473173 | 422.882160698845 | 508.534141784435 | 359.414835268894 | 476.536522272088 | 455.512984179919 | 260.894920411003 | 311.866130630911 | 347.615496257633 | |||||||||||||
0.83_169.9630m/z | 169.962979962926 | 1 | 0.825683333333333 | 0.0685833333333333 | 1 | 0.0145006264951694 | 1.79062344516987 | D20 MA_VO | D20 VO_MA | 100 | 35.1991734497779 | 13.03 | 46.4010404729375 | 24.2961526569765 | 31.8622912177132 | 37.8944514564712 | 22.9084525606688 | 17.3693246044119 | 20.3354292327996 | 24.7082982825045 | 22.53440609988 | 25.2970640570528 | 23.9357270273532 | 26.8424877614687 | 21.690983241837 | 28.2385456129001 | 18.4400820925419 | 14.4169983160692 | 36.2736551097174 | 32.9354413751318 | 20.8819686706869 | 21.2833966644457 | 23.7165488502759 | 32.0450151422741 | 14.6306633801075 | 36.675094578755 | 20.4342095748845 | 27.5477328198888 | 27.2142037572996 | 23.7919290823825 | 30.6692319363746 | 41.0634488829827 | 31.7655993287376 | 37.2984136510166 | 29.1362074636285 | 13.0387675987406 | 22.0065818254531 | 14.4484276457237 | 28.7328177413412 | 16.2910690307554 | 22.9764230629244 | 25.5830705489425 | 27.272753016795 | 20.1704020500211 | 23.0533899272538 | 24.7082982825045 | 21.4015121459931 | 23.4275508806336 | 22.215362234872 | 24.3806296313163 | 22.8551783363726 | 29.2461723260456 | 20.8187699348307 | 15.1060787854973 | 37.3018115643984 | 32.099655859739 | 20.2195737325399 | 23.9106266908227 | 23.7374830421552 | 33.8083692960064 | 13.8521500825885 | 33.5658754904421 | 23.6167901391496 | 32.9181900024399 | 27.0520854400631 | 26.0918808471999 | 28.3152826009744 | 39.0396670504297 | 32.6666328617997 | 39.9963691185874 | 36.2406629800608 | 12.5450515747025 | 22.8418332975562 | 17.4287264347102 | x | ||||||||||||
3.64_426.9627m/z | 426.962688896448 | 1 | 3.64286666666667 | 0.622866666666667 | 0 | 0.0146240102992542 | 1.31125071623283 | QCs | Blank | 100 | 253.722199036716 | 2.61 | 241.07434225105 | 229.744249851741 | 139.472206323354 | 163.694514666835 | 233.631623721084 | 217.363755145668 | 275.04837483993 | 259.520590298727 | 275.864496652391 | 246.895436248378 | 267.072745140862 | 254.380570246684 | 223.436633120322 | 256.466954500487 | 222.725435251843 | 267.188823905047 | 239.530124863789 | 226.191925740919 | 237.042282744729 | 238.412567950839 | 239.179360614273 | 220.47451058712 | 229.274471054052 | 259.19489136051 | 200.012371864851 | 213.477049305309 | 251.355415744529 | 207.122961660066 | 248.933569283437 | 234.319553824128 | 233.743929264787 | 234.090920439674 | 230.91262970756 | 242.073247151515 | 247.820486304217 | 233.572717134747 | 149.27995293668 | 154.048234985843 | 100.57570549802 | 110.512440640737 | 278.140898159028 | 252.41708772469 | 311.810356272939 | 259.520590298727 | 261.995694476538 | 228.649276527111 | 247.877065509048 | 231.050062263233 | 235.428889502527 | 265.618380283397 | 251.456016945746 | 279.959485048652 | 246.319472207594 | 220.451971231737 | 229.523087083961 | 267.842299824062 | 239.390480143521 | 232.606651648992 | 217.074530432092 | 237.221022906517 | 231.163833093476 | 255.09460673725 | 249.858061003152 | 227.145416314952 | 229.827221553921 | 222.771287204036 | 240.374092802319 | 251.023728483956 | 287.217435608865 | 232.907086300455 | 257.226418931315 | 281.752110982007 | |||||||||||||
13.70_1301.0821n | 1301.0821354999 | 1282.0642943799 | 1 | 13.7003333333333 | 0.0857166666666664 | 0 | 0.0146819506096337 | 5.80787689186809 | Blank | D6 MA_VO | 100 - 45.9 - 7.62 | 289.340481291437 | 24.5 | 455.333474120798 | 497.139955065574 | 95.0852861204971 | 109.803209858877 | 165.238238046244 | 173.174244069917 | 155.249484617269 | 74.625949840053 | 87.3553744430946 | 64.5469029864265 | 58.6204950060206 | 61.7031167577611 | 80.0533930114181 | 19.8338405481485 | 118.81119396029 | 38.1370918741869 | 43.0308636853037 | 24.2723805254472 | 49.1718018886001 | 131.409558538698 | 63.2071130526261 | 81.7086060276473 | 11.640522751009 | 42.7182859718516 | 120.361454418584 | 121.70170544465 | 97.920364805263 | 68.3218747669163 | 48.5073885854471 | 186.035578848648 | 73.8238442585232 | 100.039696973204 | 150.544602195432 | 87.8191771002417 | 96.1587848471237 | 135.552293979629 | 281.955180101511 | 333.342543581456 | 68.5675661563599 | 74.1296721908426 | 196.7178552646 | 201.101321274833 | 175.99957512155 | 74.625949840053 | 82.9636733657522 | 59.776733398445 | 54.4071851027564 | 56.0440168637531 | 84.3500063279165 | 20.5415649414138 | 134.137304830234 | 39.9599071783961 | 44.2505494356016 | 23.6564329862534 | 47.6120278469744 | 147.63080101183 | 63.262904889842 | 86.204818908023 | 11.0211180448592 | 39.0967408418594 | 139.107470706392 | 145.427570742067 | 97.3370412986489 | 74.9265101414459 | 44.7843108324862 | 176.866952371236 | 75.9178629649893 | 107.276000638779 | 187.252791855036 | 84.4938831547908 | 99.8084550792503 | 163.512868479333 | M-H2O-H, M+Na-2H | |||||||||||
3.66_459.2866m/z | 459.286591063269 | 1 | 3.66001666666667 | 0.371433333333333 | 8 | 0.0160211306125131 | 1.52498534863378 | D6 MA_VO | Blank | 100 - 22.8 | 1679.33332230739 | 6.21 | 853.05024190567 | 942.55611120925 | 1306.5278358183 | 1302.7168447161 | 1128.54264198768 | 1165.27929494185 | 1291.37846306087 | 1586.91335361128 | 1674.24817954271 | 1787.45394692161 | 1786.98518487501 | 1797.26112909295 | 1578.26205618499 | 1635.07219275592 | 1360.79938799135 | 1256.77460370397 | 1697.39684618822 | 1491.94630569973 | 1523.43029418593 | 1424.51191359995 | 1796.03317921428 | 1602.3273638068 | 1580.99550175642 | 1737.97724445208 | 1387.87054130384 | 1352.06305387339 | 1554.76126576513 | 1668.70527390447 | 1560.06630001727 | 1713.47197871154 | 1630.4394460454 | 1254.17963152926 | 1305.21390367647 | 1610.35843893502 | 1473.81712472858 | 1430.08995957876 | 528.232489510184 | 632.003218363919 | 942.15874477224 | 879.482237180569 | 1343.54185043011 | 1353.19895360652 | 1463.979486825 | 1586.91335361128 | 1590.07708439589 | 1655.35685065479 | 1658.54678844648 | 1632.42536714782 | 1662.97029293095 | 1693.41593474346 | 1536.33640261876 | 1316.84389239359 | 1745.50860989896 | 1454.08596255615 | 1475.10570700727 | 1600.3541690137 | 1797.61850697139 | 1690.49928696124 | 1496.86903466071 | 1590.63605595425 | 1604.02814672932 | 1615.6490551756 | 1545.49936406268 | 1830.01802943545 | 1440.3268478613 | 1629.02477431361 | 1676.68697940092 | 1344.89986499174 | 1623.47200674888 | 1549.3818351474 | 1529.75529508163 | 1725.07675531744 | |||||||||||||
1.50_526.1322m/z | 526.13215572105 | 1 | 1.49996666666667 | 0.148583333333333 | 0 | 0.0161217281363679 | Infinity | D0 MA | Blank | 100 - 23.7 | 87.8234679457041 | 48.19 | 0 | 0 | 0 | 0 | 3.33563652247038 | 3.19875437779835 | 9.57142552634873 | 0 | 0 | 3.3484074172533 | 8.67790715395499 | 0 | 328.538092647131 | 18.3628652214978 | 4.392913914187 | 0 | 0 | 0 | 0 | 0 | 3.57286557979138 | 2.35609758333443 | 4.68086717812549 | 1.36438464155918 | 0 | 0 | 0 | 3.79831586927328 | 3.38145375879315 | 0 | 0 | 0 | 2.62817004840531 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 3.97111026116727 | 3.71460395432239 | 10.8507080078098 | 0 | 0 | 3.10095214843409 | 8.0541882285585 | 0 | 346.171338294112 | 19.0181012871477 | 4.95958009644463 | 0 | 0 | 0 | 0 | 0 | 3.57601928710682 | 2.48574752862937 | 4.43179321289126 | 1.24871566183161 | 0 | 0 | 0 | 4.1654968261692 | 3.1219177246104 | 0 | 0 | 0 | 3.2690124511725 | 0 | 0 | 0 | x | x | |||||||||||
13.08_726.3532m/z | 726.353171698043 | 1 | 13.07745 | 0.0857166666666682 | 0 | 0.0169750612215998 | 2.98653592527052 | Blank | D6 MA_VO | 100 - 16.3 | 67.3952495055596 | 13.18 | 104.277786625491 | 78.4769844520606 | 35.9086868056657 | 50.9175401390214 | 38.0870803211552 | 23.0587456286271 | 34.5279381712022 | 31.4064862547552 | 48.8574070168068 | 24.4403115201537 | 32.5971031543172 | 29.6103228076455 | 21.293937060105 | 27.5230465546896 | 39.3299934441807 | 27.5525397782921 | 33.0964632126016 | 32.5009014296302 | 36.8058169102376 | 42.917232783249 | 31.9526672575104 | 9.0363179580644 | 3.01160729821294 | 46.2648537315374 | 28.4977421408928 | 29.6329758313247 | 18.9983073207509 | 26.4190228705842 | 18.1003953325445 | 27.6592368221128 | 27.4068605348331 | 26.4524405736194 | 22.7091832472492 | 46.8156584384905 | 32.6474788865291 | 36.4769481981692 | 64.5717123375318 | 52.6204288013859 | 25.8943455774566 | 34.3751386149898 | 45.3430685454982 | 26.7773319165465 | 39.1428188179557 | 31.4064862547552 | 46.4011514240655 | 22.634114393101 | 30.2542075932391 | 26.894612751699 | 22.4368219534421 | 28.5051423508337 | 44.4033861098679 | 28.869451706013 | 34.0345639409738 | 31.6761430077617 | 35.6383030996297 | 48.2149512064328 | 31.9808713301875 | 9.53356312193945 | 2.85135644234597 | 42.3426398151912 | 32.9361991279698 | 35.4099531577057 | 18.8851320964948 | 28.9729342438719 | 16.7111393625249 | 26.2960717079894 | 28.1842581252982 | 28.3658599309127 | 28.2464990559724 | 45.0429724409878 | 33.8866015734015 | 44.0011028817483 | |||||||||||||
13.70_815.4851n | 815.485092792818 | 796.522389497191 | 1 | 13.7003333333333 | 0.205833333333333 | 0 | 0.0173328217131785 | 1.4385659464351 | Blank | D0 VO | 100 - 32.4 - 7.28 - 5.22 | 329.819433902383 | 6.8 | 355.251054505731 | 393.323256670793 | 294.771646603933 | 275.931777829075 | 264.423446302984 | 257.843282784509 | 227.320859288697 | 253.825673078505 | 240.590052464326 | 220.875392094721 | 230.180716774719 | 258.52880885373 | 279.219454033029 | 193.09265932936 | 277.819048510612 | 233.551481060371 | 192.220400874526 | 226.648719407984 | 205.771967208177 | 292.437298021512 | 231.530184792447 | 261.468078136129 | 191.235301472682 | 254.633404547015 | 273.606078975077 | 228.2267110514 | 269.277946376853 | 256.396363914011 | 224.618581778261 | 306.800877270942 | 307.054682553426 | 236.453800009412 | 305.89900184953 | 238.830649161841 | 282.344326403877 | 258.187123188026 | 219.981355967344 | 263.731316488312 | 212.564690123779 | 186.285376026756 | 314.798885859818 | 299.424577415048 | 257.703751801223 | 253.825673078505 | 228.494636477142 | 204.552175497864 | 213.636627656608 | 234.817845264551 | 294.205677343421 | 199.982721031535 | 313.656459088938 | 244.714398657812 | 197.668780567246 | 220.897173084195 | 199.244694246476 | 328.535861719201 | 231.734552525074 | 275.855989004721 | 181.059465881115 | 233.046247075898 | 316.219588737701 | 272.719729320079 | 267.673824943618 | 281.182049330057 | 207.378477350723 | 291.68042201153 | 315.764310934783 | 253.55752534562 | 380.488182815307 | 229.787270051838 | 293.060598296501 | 311.443767401275 | M-CO2-H, M-H2O-H | |||||||||||
15.54_812.4972m/z | 812.49719567531 | 1 | 15.5407666666667 | 0.131449999999999 | 7 | 0.0175766430786438 | 2.10745173184025 | Blank | D20 MA_VO | 100 - 38.2 - 21.5 | 100.75373003208 | 16.96 | 97.6505638017671 | 116.873622230984 | 110.402086189469 | 78.0886479061017 | 52.966333250971 | 87.5439713111226 | 62.8277751793283 | 90.2605618321839 | 53.019056452525 | 63.5110225246242 | 78.7957393342064 | 72.1656373826524 | 62.4625191101079 | 41.2337269946732 | 76.9122247646028 | 79.5848717740105 | 51.3106021106667 | 47.9457456722468 | 34.5776414804579 | 59.1560724336906 | 69.1340828304529 | 37.0825996008676 | 36.4369256920831 | 66.7053461543115 | 80.6890862292722 | 68.0381212861698 | 50.9665669294034 | 77.8915916457719 | 25.7852624282218 | 23.0679982101109 | 80.2963210204521 | 62.083704513043 | 80.1398809826354 | 39.6518003514915 | 47.4344516633185 | 75.9858180481377 | 60.4679512238911 | 78.3661625163793 | 79.6127629989296 | 52.7187308872414 | 63.056975198713 | 101.661816945509 | 71.2251107606196 | 90.2605618321839 | 50.3535782398031 | 58.8174069655279 | 73.1323468835331 | 65.5469676569967 | 65.8149977658501 | 42.7050564806862 | 86.8335566248846 | 83.3887413173876 | 52.7649724131377 | 46.7290514946539 | 33.4808074103125 | 66.4583189778218 | 69.1951063024811 | 39.1231589748315 | 34.4980777782855 | 61.0502404773475 | 93.2562235408723 | 81.3022188994871 | 50.6629528997737 | 85.4213259119515 | 23.8061714134239 | 21.9311089092627 | 82.5739320005633 | 66.5744871936477 | 99.6808668931745 | 38.1503755375863 | 49.2348082972766 | 91.6595264309344 | |||||||||||||
3.66_470.1817m/z | 470.181723401558 | 1 | 3.66001666666667 | 0.154283333333333 | 0 | 0.0177154624521225 | 1.90176891727882 | Blank | D20 MA_VO | 100 - 30.8 | 112.286180934588 | 3.41 | 152.846711110909 | 152.545990817869 | 75.0471626677599 | 68.7048591418134 | 97.8435378679238 | 89.1694990747239 | 105.422807528223 | 76.8870936977327 | 55.7940340689811 | 63.6223326205834 | 78.3183340795809 | 73.35045837676 | 78.1286031449381 | 93.4202837360722 | 76.8532780212853 | 99.3357026145324 | 77.9801382178091 | 54.386205047408 | 50.7040984985667 | 72.4754152299455 | 76.9362431691687 | 62.5618120042853 | 82.4269494353187 | 63.9515694577237 | 71.184111905845 | 74.1650423397726 | 69.7238868780947 | 74.9676957458844 | 52.1216929023264 | 67.0244567328771 | 63.2131452676945 | 53.8127866037326 | 101.180298904513 | 67.8426040626455 | 76.3207067515574 | 87.9496600019918 | 94.6469442915735 | 102.285217822966 | 54.1177452476475 | 46.3836047474971 | 116.483757927096 | 103.549486689846 | 119.513242693396 | 76.8870936977327 | 52.9890467274222 | 58.920490980761 | 72.6892548206842 | 66.6231228216536 | 82.3219094377029 | 96.7537689209147 | 86.7670060161955 | 104.083590565126 | 80.1904415964746 | 53.0060746918413 | 49.0957186222044 | 81.4218061687722 | 77.0041534746326 | 66.0044264194441 | 78.0409230097115 | 58.5299218036584 | 82.2708715970277 | 88.6235891440406 | 69.3085332152547 | 82.2147787183499 | 48.1212071835482 | 63.7212057502509 | 65.0061907263077 | 57.7052980440631 | 125.851695605809 | 65.2737277877559 | 79.2174302487278 | 106.091167965544 | x | x | |||||||||||
2.38_403.1861m/z | 403.186119341661 | 1 | 2.37998333333333 | 0.165733333333333 | 2 | 0.0189166986761011 | 1.87021774117894 | D0 VO | Blank | 100 - 2.89 | 63.516280413852 | 7.21 | 31.4537913615891 | 10.5955005877733 | 42.0439430144468 | 51.7546484464139 | 37.2505796934373 | 42.4523474969566 | 40.3577450374749 | 55.0330769283406 | 60.5886559035832 | 53.4371565280828 | 70.3439498115848 | 64.9863251663334 | 62.1852585140333 | 78.950956343407 | 50.6710961518776 | 55.6492866632273 | 65.7797609227237 | 56.9178339675289 | 64.1237598879957 | 67.2437668771596 | 47.6817624213015 | 60.5568557375309 | 62.7687469196099 | 52.6781170451671 | 46.3546259400867 | 50.5467999224251 | 69.149613408497 | 70.1635293743492 | 49.7653814214816 | 56.8400409638438 | 67.5250541691661 | 50.8593799605804 | 48.6669206940861 | 49.980465113354 | 60.0797267843019 | 57.4869760389289 | 19.4770644204371 | 7.10450061488477 | 30.3185798953585 | 34.9402820611148 | 44.3472057757311 | 49.2984578550233 | 45.7518168061562 | 55.0330769283406 | 57.5426239095262 | 49.4880236162826 | 65.2880242288099 | 59.026105890789 | 65.5228560819862 | 81.7681372892862 | 57.2074401750242 | 58.3091216536009 | 67.6442514345154 | 55.4734597854505 | 62.0896962115958 | 75.5443612893988 | 47.7238502971544 | 63.889142604229 | 59.4287545436007 | 48.212203352661 | 53.5742510026593 | 60.4009475023077 | 68.7376807624671 | 76.9461964145702 | 45.945749199649 | 54.0387214109733 | 69.4404072370747 | 54.5382587334359 | 60.5336666878632 | 48.0879429613582 | 62.3600300425801 | 69.3449006015385 | |||||||||||||
15.07_1909.4320m/z | 1909.43201095577 | 1 | 15.0664666666667 | 0.119999999999999 | 0 | 0.0191069539760602 | 17.3770076219169 | D0 MA | QCs | 100 | 89.5319234221327 | 43.07 | 0 | 0 | 0 | 47.2195583367832 | 0 | 0 | 0 | 0 | 4.57458712741306 | 0 | 6.01529197039462 | 30.6286898849024 | 39.7029895471908 | 188.740991291054 | 117.877114959263 | 11.806597891024 | 21.5711344188485 | 5.71058845241806 | 0 | 9.45065618650155 | 22.7936621626979 | 51.316637526756 | 23.0547247290077 | 200.244389513305 | 3.44081198041381 | 4.3749445607304 | 5.48918165543452 | 8.9181044957936 | 0 | 138.748469569343 | 0 | 0 | 12.5800035282105 | 101.614214193343 | 6.05144753225849 | 0 | 0 | 0 | 0 | 31.8785797336971 | 0 | 0 | 0 | 0 | 4.34460449218386 | 0 | 5.58294677734762 | 27.8195803165522 | 41.833922255676 | 195.475773857318 | 133.082733829641 | 12.3709106445344 | 22.1825561523475 | 5.56567382812204 | 0 | 10.617248535157 | 22.8137817382886 | 54.1404591269837 | 21.8279580878877 | 183.268191214337 | 3.97671043511179 | 5.22784423828477 | 5.45648193359364 | 9.78021240234057 | 0 | 131.910353443024 | 0 | 0 | 15.6474609374942 | 97.7665679002887 | 6.28112792968523 | 0 | x | ||||||||||||
2.04_274.9517m/z | 274.951697062983 | 1 | 2.04283333333333 | 0.268566666666667 | 0 | 0.019834059278474 | 1.2979151457999 | D20 MA_VO | D0 MA | 100 - 0.137 | 144.765534659209 | 4.46 | 141.403132558033 | 112.676403755898 | 153.181780753859 | 158.620699438654 | 114.563245608896 | 111.556501464436 | 122.548513818378 | 129.097739757601 | 139.068116335366 | 139.986181633097 | 139.69907985137 | 144.393943106092 | 96.3087916530356 | 116.945801924109 | 113.114970748064 | 119.778352594247 | 129.141612989804 | 119.629370519679 | 111.304489080767 | 128.377598902049 | 110.677330010918 | 131.608536354583 | 137.631084696949 | 116.135035020248 | 116.094607900584 | 114.149833266332 | 134.152148235542 | 115.533217559266 | 143.691007790327 | 151.015085034348 | 148.156080381824 | 136.199965430336 | 87.2615298316034 | 126.088392454694 | 128.986686348318 | 119.393167040682 | 87.5607614491811 | 75.5518413816648 | 110.461905456948 | 107.087037502656 | 136.388745334033 | 129.546746179175 | 138.927909596505 | 129.097739757601 | 132.076610658382 | 129.640869999721 | 129.658299462971 | 131.150856029388 | 101.477862208899 | 121.118740418332 | 127.706294384747 | 125.503325409217 | 132.802059739981 | 116.593598387249 | 107.773809989976 | 144.224575203208 | 110.775022996426 | 138.850613108709 | 130.307586998669 | 106.289408939272 | 134.176072777723 | 136.403453771523 | 133.352987594298 | 126.701745621886 | 132.66232102723 | 143.57241779992 | 152.35853836694 | 146.051897602409 | 108.539029923486 | 121.314025603788 | 133.882327139271 | 144.020574248547 | x | x | |||||||||||
18.49_494.1023m/z | 494.102332869969 | 1 | 18.4894 | 3.88026666666667 | 0 | 0.0203121581089641 | 1.91965015248526 | Blank | D0 VO | 100 - 9.57 | 4671.44659666651 | 5.43 | 7090.10041267391 | 6017.10348357059 | 2649.43145837797 | 2929.15103204357 | 3653.2100180347 | 3554.2889634134 | 3301.44981703373 | 2733.98587212022 | 2464.88257783004 | 2421.81228660069 | 2411.77488497249 | 2240.53465726026 | 2891.5520883396 | 2432.92462249157 | 2867.02208421672 | 3462.75212812582 | 2186.26056790992 | 2147.11945817444 | 2606.61486728095 | 2793.95916199976 | 2753.61781308495 | 2105.29784585104 | 2906.85018876518 | 2415.05846340002 | 2481.33195181997 | 2790.1953363456 | 2453.15898556174 | 2160.52997848747 | 2970.52190145981 | 2516.63253477101 | 2174.01025665996 | 2768.78141752143 | 2947.083112266 | 2606.76757481668 | 2740.98093445362 | 2882.72196480844 | 4390.38781994516 | 4034.59138572295 | 1910.54866858009 | 1977.51054893504 | 4349.1848380628 | 4127.47409739759 | 3742.70978429016 | 2733.98587212022 | 2340.96315625363 | 2242.8346008739 | 2238.43013572985 | 2035.04407416377 | 3046.74702437855 | 2519.73786968558 | 3236.85506766413 | 3628.25917818233 | 2248.22890023574 | 2092.63312770384 | 2523.93068548685 | 3138.84647104188 | 2756.04838441407 | 2221.14693142153 | 2752.17357109889 | 2210.3160909524 | 2867.7936260243 | 3334.14661839009 | 2438.54521952252 | 2369.38713839902 | 2742.52603673652 | 2392.60215394267 | 2235.67621555467 | 2969.0593444543 | 3665.68799248109 | 2508.06170304746 | 2845.01382691588 | 3477.34533777083 |