Quant m/z Other ID Compound Retention time (min) SD_02272014_NEG_HILIC_LUC_68 SD_02272014_NEG_HILIC_LUC_92 SD_02272014_NEG_HILIC_LUC_67 SD_02272014_NEG_HILIC_LUI2_67 SD_02272014_NEG_HILIC_LUI2_68 SD_02272014_NEG_HILIC_LUI2_92 SD_02272014_NEG_HILIC_OUC_74 SD_02272014_NEG_HILIC_OUC_75 SD_02272014_NEG_HILIC_OUC_91 SD_02272014_NEG_HILIC_OUI2_74 SD_02272014_NEG_HILIC_OUI2_75 SD_02272014_NEG_HILIC_OUI2_91 SD_02272014_NEG_HILIC_UPALL0001 SD_02272014_NEG_HILIC_UPALL0002 SD_02272014_NEG_HILIC_UPALL0003 293.1078421 3.53_293.1078m/z 3.53 349.9425451 362.5641911 437.8616694 278.2348654 236.2329789 261.4347854 363.6187725 278.108209 449.9390234 453.7431125 168.6471316 386.1219457 389.9090526 394.2750227 351.3470853 377.0126611 1.16_377.0127m/z 1.16 598.9740262 432.1350865 602.8245532 515.1061491 649.4245857 472.3266547 626.8392506 726.0724086 801.7131161 575.530085 240.8914546 789.7549171 610.355853 561.5807463 636.143562 363.1833908 1.40_326.2110n 1.40 101.3145089 182.2660916 85.91408582 116.0201845 106.6473636 39.0878086 231.2160192 322.1119916 302.1260643 212.8451919 219.7786957 180.2162279 137.1135753 158.0870283 155.5326609 488.01584 1.16_488.0158m/z 1.16 27.85776513 8.33310578 121.5821452 3.974610836 40.9845137 32.35045849 79.05647114 87.55825737 57.16427463 47.07532699 15.50973391 82.20413716 50.38481566 33.9508822 91.44615124 149.0462282 9.92_149.0462m/z 9.92 666.4752149 594.738601 524.3140282 887.959362 952.7813521 550.6382276 1201.325588 944.6263321 782.652826 952.0320339 1632.24042 521.9376829 828.9968545 626.5523906 698.2485759 196.0290177 7.52_196.0290m/z 7.52 676.8106868 660.7960896 805.5654016 692.756356 740.5721737 881.2485888 1215.338886 632.2187465 1105.566273 1477.069993 1105.251943 936.4502414 965.4999756 935.8393975 1064.242823 206.9977427 1.05_206.9977m/z 1.05 331.9463632 220.0664242 122.8203016 255.7612577 289.2611858 82.80883907 177.3580869 144.959152 228.0392743 139.2163206 180.3223991 309.0890067 184.6664962 151.0632284 193.143678 363.1658676 4.20_382.1837n 4.20 410.5419977 178.6422513 195.2518282 241.3320316 280.5719782 322.6985662 253.5356059 131.0712888 306.613941 292.8905502 20.05935576 354.2687275 310.0950454 279.102914 321.9602195 363.1668291 7.71_363.1668m/z 7.71 116.2791359 47.16663323 20.44912563 153.4963543 132.7469522 77.36341231 56.55926487 31.80700878 69.53750466 73.46379006 31.50418281 85.48406145 84.74910673 87.47925835 63.73841981 195.0514331 11.68_196.0590n 11.68 1364.816344 1802.341061 1171.762018 4194.842505 2207.650527 1259.715463 2940.981721 2266.685784 13758.12944 2481.362583 2565.72805 430.9479076 2096.412265 2181.126095 2771.236501 352.1235325 3.91_352.1235m/z 3.91 103.1189592 88.23615287 394.415383 337.0746636 250.5961177 282.8047679 46.45402669 66.87715123 87.86660131 212.630536 72.54987539 65.91134925 234.195703 189.9211469 246.2819696 165.0773313 8.45_165.0773m/z 8.45 141.9663782 196.5502795 134.6458946 325.5215569 234.0568419 189.7631171 213.9017976 186.2367249 150.1765001 175.6951582 180.6875751 155.1938708 218.5664062 228.4002021 197.1907051 200.0581111 4.73_200.0581m/z 4.73 39.41634413 42.12089576 28.17027107 29.47965836 37.36786214 42.31312543 46.34715295 31.28339552 60.42477406 28.89592163 47.89366172 38.391175 42.10806536 37.07913659 34.27066311 184.0634187 3.15_184.0634m/z 3.15 391.9172055 242.354943 168.3530092 333.3521155 277.5810917 416.7465353 184.2778791 191.0063124 145.6833723 200.9669578 203.4432885 142.2676957 267.0644034 255.4357108 272.3001689 216.0890735 7.37_216.0891m/z 7.37 109.3798805 43.54269048 55.6879543 74.62646747 111.3312948 134.5437751 200.1921559 95.84380188 20.86617471 50.49797941 175.4504453 14.06263595 49.85792269 61.78499443 53.17000593 216.0889665 7.18_216.0890m/z 7.18 4.488399924 53.25492523 32.48398896 50.29914405 20.56932792 41.20579061 20.40068385 3.553899739 29.9288336 20.64447854 16.59147361 15.16703983 45.09959706 16.56895357 46.61293908 131.0361332 2.96_131.0361m/z 2.96 1497.731737 1016.21353 571.6316284 1516.25146 1611.653533 1321.751453 932.4807748 824.6207752 1075.503259 907.1375877 1035.760292 1051.657511 1230.512155 1060.460739 1193.015664 490.0491366 1.10_490.0491m/z 1.10 38.31037648 26.84720879 28.16097545 31.94841285 20.9824328 39.2786057 12.06544673 14.95135671 51.02713602 32.11554583 12.72373964 59.22684045 31.61875037 29.48155432 44.38347953 206.9773613 1.39_206.9774m/z 1.39 73.14626602 28.83057222 101.9133366 21.10629263 64.05954674 66.50376302 73.04217518 72.64249692 67.75576078 40.74175604 59.89266844 60.08569148 52.87778473 57.78192286 55.59715742 358.0398296 1.13_358.0398m/z 1.13 108.3265906 10.72208357 51.91471741 18.93062399 96.29199124 16.42720273 4.188836728 0 0 89.73321512 0 10.41052454 49.98376465 37.49784894 11.50249405 209.0850851 3.51_209.0851m/z 3.51 94.0946769 37.32500462 142.7118043 23.49973502 16.34371747 149.3171767 75.82881414 71.50887495 38.18384254 67.4160128 14.47298942 54.00635278 119.8074869 95.71855613 120.6025541 193.0358603 12.88_193.0359m/z 12.88 312.6695593 350.5115424 447.5598001 1621.373865 470.6697081 532.0426774 1492.573497 1316.668854 1453.470571 871.6655324 1735.553933 250.520596 407.6195223 316.5063003 1074.546896 376.0370332 8.12_376.0370m/z 8.12 35.93253935 56.64823219 47.96247328 63.19086387 76.35424069 33.6749682 109.9586944 122.2101862 65.08054162 57.86016639 216.9685 62.81176655 70.25161731 74.83764828 66.12740109 145.0513023 3.34_145.0513m/z 3.34 914.7633232 527.1375736 589.7086916 753.6063653 954.7472023 504.0132566 1182.631315 1174.234007 733.7464407 1385.408159 1079.905871 934.8695854 805.655945 861.1909786 775.9189779 192.0665449 3.86_192.0665m/z 3.86 35207.39976 72767.63579 79969.75163 67500.55254 59285.11323 69752.59576 64012.7377 50595.05527 57070.63758 36684.75867 45163.28051 29939.93704 60419.09967 57069.29076 60017.60474 115.0405959 3.53_115.0406m/z 3.53 2245.622818 1977.714355 1366.999293 2886.213332 2594.391678 3076.98797 1620.477416 1147.329945 1743.267141 1609.895972 1331.090752 1574.443458 2078.337388 2071.080338 2100.999714 186.0243868 1.39_186.0244m/z 1.39 13.53654392 54.68191442 28.29413087 36.29538757 9.344619123 19.41924232 7.719554391 7.716703559 0 8.009375681 0 3.025349232 24.41188812 23.59420385 24.74235582 181.052715 1.20_181.0527m/z 1.20 185.1338386 143.7989423 208.4596078 154.8463632 165.2613884 132.5294803 120.6498487 106.4194499 163.4866299 176.5636817 103.6350918 174.7984549 166.7200571 140.7419791 183.8529781 175.0253929 5.52_175.0254m/z 5.52 1451.438688 1047.315033 1382.870449 1576.197117 1572.330715 958.0911123 3076.997703 3281.280147 2821.728698 3465.87253 3988.473134 2068.332844 1892.358543 2123.788437 1817.037287 160.0413359 1.39_160.0413m/z 1.39 2524.590099 1702.488905 930.3271679 2216.805768 2712.800549 1424.471013 1046.469428 821.0697642 1168.684989 1776.316229 1481.539867 957.3087918 1699.142602 1696.592917 1711.943747 194.046532 3.32_194.0465m/z 3.32 2247.52065 2493.917582 3109.978579 2274.201237 1918.693238 1887.68261 2397.898653 2172.021945 1879.551804 2917.917278 2198.131548 2779.299338 2321.00751 2131.417183 2299.735031 189.0776155 4.40_189.0776m/z 4.40 902.9258618 61.08176683 47.49588689 1044.950357 689.0480154 110.799202 137.4661533 94.26090795 161.4127231 65.60874406 38.68462453 65.88676113 338.6967014 285.5934647 305.3441811 481.2086905 7.16_481.2087m/z 7.16 377.9794533 241.3211569 246.504748 201.6248279 409.133736 313.1446733 443.8366539 396.1113203 202.4722088 323.5872519 267.3248192 191.7675886 308.1453594 301.1482479 282.2812752 336.0723305 10.40_336.0723m/z 10.40 6562.985259 6806.541175 2529.287243 7582.791795 12281.74719 7394.064661 6425.896813 5626.272002 4378.51158 10379.22738 8373.415225 3458.099587 7355.538025 7488.630139 7469.603628 114.0313909 5.62_114.0314m/z 5.62 2334.643658 2498.041262 1671.480874 2889.970283 2692.626103 1786.898822 2622.490509 2131.043489 2454.921968 1942.70531 2990.549714 1950.618408 2336.672018 2306.540003 2334.312114 245.0127429 2.26_245.0127m/z 2.26 98226.08239 117329.71 90627.75375 65384.64592 109000.7078 92951.63776 133716.2379 292702.3968 182863.0804 176745.275 189493.9242 237854.9165 137943.1578 144187.2843 140266.206 152.0031801 7.59_152.0032m/z 7.59 170.1946102 250.0886653 210.6904132 242.6780078 190.3185837 214.4732455 152.2425484 114.9326311 164.4290652 192.564753 199.5268545 161.8488612 211.2604676 144.590944 225.5180501 460.1491299 4.16_460.1491m/z 4.16 301.4411647 211.425458 183.4055984 392.4756683 262.082368 366.0846189 224.1680207 109.4590329 221.8968817 169.6012645 144.4204343 164.0530178 281.026527 286.8807598 186.094338 173.0633431 1.03_173.0633m/z 1.03 212.3473416 632.2881023 3119.251871 2473.895626 932.9607166 1864.000991 1415.087669 1491.496329 577.8247958 2553.052016 595.0839144 469.8052747 1413.884163 1412.947007 1473.450524 489.1419934 7.76_489.1420m/z 7.76 65.12207028 70.56350027 73.27384226 30.16895045 44.01420541 46.48203883 80.48027079 78.06629744 67.56745264 73.26016359 39.31914295 62.49192252 69.10161179 71.40145764 54.85826426 320.1506959 3.65_320.1507m/z 3.65 385.8608231 475.3501256 640.3935566 313.7300586 372.3837329 567.1718767 545.0950577 506.5282247 399.2436205 841.0884372 464.339797 986.2589755 524.5728063 567.0049074 562.0508047 206.0464943 4.57_206.0465m/z 4.57 13469.19204 13823.28149 14713.53388 14486.15005 6578.372657 10224.93651 13668.38391 17417.03636 19272.1196 6128.412613 8538.180554 9172.244019 12318.61974 10191.44224 12725.18218 243.0708399 3.91_243.0708m/z 3.91 462.5127933 441.9105185 531.4041401 503.6499217 540.9161623 778.3148218 465.2100037 325.9041422 442.970992 453.2330807 479.1156128 601.879641 554.7625621 364.6396359 539.6013624 144.0669561 5.21_144.0670m/z 5.21 15255.4315 5873.399561 4230.186371 13269.45667 15658.9981 12660.02583 5349.488808 3798.923645 5780.916182 5397.418262 4515.917517 6252.074236 8773.599537 10144.31209 8651.46051 165.0646267 3.48_165.0646m/z 3.48 77.86754523 49.41584999 197.8593723 92.05871088 39.50081428 143.5991837 76.80050278 116.3664006 119.6213918 276.1005573 75.40286565 196.6955399 162.0472313 139.3744956 168.2461148 144.0767351 9.80_144.0767m/z 9.80 51.46801297 54.77581133 74.21882312 66.02408591 85.82915695 35.9926728 97.27290749 57.32294378 69.89570318 88.86648745 112.1799514 84.68541041 69.73194641 76.09810465 67.53399151 305.0346318 4.64_305.0346m/z 4.64 749.3062167 2187.26258 1456.151074 133.6319032 547.4339337 473.1429149 720.0785373 996.2589395 577.9300072 786.0056511 661.0965204 446.1028533 836.0714568 790.4069427 786.43285 179.0359513 1.95_179.0360m/z 1.95 1794.390374 805.2204035 1789.867845 1459.191325 959.9596269 1556.358897 946.6481141 721.3996397 1413.875657 2326.140369 1903.313367 1608.791009 1455.800657 1254.425281 1515.864168 247.0284929 1.08_247.0285m/z 1.08 1381.855073 1268.68489 1872.50244 1317.347259 1233.577372 1119.199168 1112.169131 1484.077708 2392.843182 1256.299744 1513.42238 2456.116441 1584.426226 1615.099492 1548.59313 229.0188674 2.30_229.0189m/z 2.30 306.5986502 352.1016419 355.2803007 303.1711174 245.2160526 249.4545525 276.6229375 199.6014453 299.8137832 308.4530378 276.3006393 222.6748142 296.4315725 304.8669343 288.4220588 293.0348713 4.90_293.0349m/z 4.90 117.7920495 73.94294645 231.0912806 68.18271239 74.12884415 88.97925511 27.59922759 62.34762125 49.89900309 89.28935638 157.1021022 113.5688105 105.5459875 101.7846057 117.133844 182.0474112 1.11_182.0474m/z 1.11 36.48812335 30.41319077 27.30732495 27.54188144 32.50484346 23.82832 15.75510736 22.64768311 33.13397263 19.83090045 19.08470666 26.2255367 27.40169525 26.17073464 28.56479335 248.9614924 9.82_248.9615m/z 9.82 121.2544895 229.0326938 129.631015 295.8097983 118.6406575 64.60508241 29.93353553 260.6281882 183.1335796 117.3836764 392.5046737 334.9214403 183.9875489 180.9062358 184.871148 100.0773682 5.21_100.0774m/z 5.21 105.846508 39.2067003 27.98898959 100.5513501 110.3513953 90.39580006 24.32401418 8.910596482 35.90560428 33.54081667 15.35447295 49.46551183 57.15378265 57.46052709 56.11346335 293.078839 7.56_293.0788m/z 7.56 240.171269 445.3777884 373.3919923 626.8395444 283.5002048 429.0827993 620.2384015 1007.484632 1541.742229 1923.454036 1073.425811 2734.807893 1016.376259 915.6738025 1076.682117 178.9869105 2.89_178.9869m/z 2.89 50.05161818 20.48397573 131.5733719 46.69504039 6.139677022 60.31205369 27.14014374 13.75482333 28.16035726 23.10973492 0.057229272 62.73295335 50.75430196 29.66281555 29.43784771 216.9816346 3.05_216.9816m/z 3.05 11701.32862 10575.63255 17565.05914 8505.300737 9349.378256 8622.184164 9115.511651 13254.91987 11935.438 12658.20419 8087.515828 15877.37086 11007.01171 11799.58284 11717.25935 453.0075302 1.35_453.0075m/z 1.35 1179.159468 1388.339128 805.5635914 1267.821232 2282.27383 832.3871479 938.6706152 804.7485051 887.47037 1201.255992 1793.477139 740.4245136 1259.555718 1174.991828 1247.979517 147.0137908 3.41_147.0138m/z 3.41 116.3564821 124.8248893 502.426569 116.2766068 40.53124824 8.618891239 342.4461986 415.4647509 715.5414429 260.1353923 168.9519125 208.8830491 283.6780171 236.3364087 305.9198919 365.0185122 10.11_365.0185m/z 10.11 44.79311017 10.83996577 62.89809181 32.74458402 20.92723716 16.65586793 83.85895262 68.83879605 41.95373664 50.88501282 41.11211146 27.91669793 47.90187303 37.38633884 47.08284216 304.0874307 4.47_304.0874m/z 4.47 0 54.97546093 33.05177336 22.66477823 37.83989503 79.17663986 3.252591513 3.433550555 71.01616708 30.77846687 0 61.18211628 62.58928373 13.20114833 112.6030176 525.031527 1.37_525.0315m/z 1.37 31.42633918 56.31128634 3.677383288 54.91665904 33.86373997 1.296893821 41.40325968 14.54877763 8.677186076 11.23420291 0 11.12705326 39.90757829 34.13115671 34.83835417 361.2026067 2.69_361.2026m/z 2.69 1155.634849 1481.876383 280.9815381 17553.96113 5990.062623 1757.884598 3277.236143 2019.142554 3993.360295 5153.885258 4700.856812 1201.267433 6424.221118 5003.416983 6029.186228 377.1973359 6.27_377.1973m/z 6.27 690.3794273 545.3242215 129.1921388 5271.116543 2340.467858 4290.018902 3413.441526 3162.966462 2681.65111 6068.934728 6208.926325 6847.212056 3202.084045 3176.111862 3190.548786 277.0202119 0.82_277.0202m/z 0.82 71.59757237 87.17758919 77.50069986 61.1133458 62.50537811 87.42044026 57.68751427 81.05878159 95.09195883 92.35351616 83.61044783 107.1519852 77.80271706 88.1217731 95.98829353 208.0299921 5.96_208.0300m/z 5.96 143.3255939 35.12235472 27.10229773 294.5552251 167.4388444 104.6757912 89.89552842 56.64011177 121.8280804 76.61499475 93.56313197 79.73100669 97.79695617 98.58991906 97.08001693 449.1504377 3.56_449.1504m/z 3.56 159.5041283 160.3880045 25.72706529 651.3298261 404.9549284 248.7964863 100.2960244 73.59850335 181.7105603 219.4761578 1096.025274 2.238700648 233.9581312 192.2435612 229.5035375 279.0185825 0.82_279.0186m/z 0.82 453.2072434 458.6475406 490.5038625 259.2022169 463.0680916 1288.897488 333.0428603 570.9166367 724.4133639 521.9049352 801.1234061 1103.605842 649.0110367 578.9622098 657.0663312 215.0044693 1.95_215.0045m/z 1.95 102.9702018 27.2547883 103.639009 75.73807638 29.61423862 79.11362377 26.71465766 34.37164318 68.35771954 104.5340067 72.67106708 79.64478231 68.01163745 62.41791946 80.4361996 530.1710611 4.57_530.1711m/z 4.57 27.48894301 45.48210663 79.95246103 34.95095418 61.03013725 38.81886754 21.0450818 17.11987946 47.01442398 66.29789796 0 98.65181099 65.72560926 24.76595104 53.16050947 677.1836982 9.68_678.1910n 9.68 154.4413225 304.4553349 32.34513165 237.5218816 354.4543048 249.6994859 140.2898996 44.9583605 233.7798371 403.8832851 69.19009838 48.8696018 215.0458923 162.9130651 217.7349076 362.0922869 5.33_362.0923m/z 5.33 0 116.0712641 40.02297022 185.5776183 187.0570612 113.2434032 0 0 121.2050684 2.698423669 0 40.19735993 48.45040602 0 142.3910995 265.0025207 0.98_265.0025m/z 0.98 213.6031167 159.2041815 155.2343366 115.4247934 147.9159005 119.4144867 149.8248498 286.0931339 394.2580524 166.0625169 224.7537225 483.5840482 218.2298043 213.6056475 235.8062651 359.192582 1.44_359.1926m/z 1.44 1.331815873 0 0.674151122 2.717627855 7.334389873 0.857438383 14.40509143 162.690708 9.685372597 5.184956783 0 3.220742068 13.42581606 15.22685319 9.67936898 158.9793285 12.03_158.9793m/z 12.03 2093.74837 2469.411186 893.1771537 45.32696524 2597.896585 542.6365467 1317.722568 473.2779345 0 207.7451063 1285.774026 1118.998568 2281.528361 3009.659412 171.6473266 175.02516 1.28_175.0252m/z 1.28 16954.52487 11100.44605 8159.651319 17332.60804 15323.22924 11801.16959 15826.77991 11944.60371 16234.93761 16057.46106 14593.41582 16070.81546 14346.25147 13832.22212 14711.48418 254.9821849 12.20_254.9822m/z 12.20 1045.678853 478.9453003 1309.842283 2483.345372 2003.38183 1369.521234 2906.257569 1688.804261 335.8120648 1674.899481 2543.650551 894.7556259 1164.701633 227.8084627 2088.499423 222.9777099 0.81_222.9777m/z 0.81 164.6242507 180.658671 154.6322242 193.1614801 165.4068433 111.1391993 124.8558261 118.2923789 131.1171562 149.6791103 156.9631628 158.4835165 137.6869433 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77.42306463 64.88059924 95.10235447 84.45123845 101.368437 539.1232809 3.29_539.1233m/z 3.29 699.9157551 702.8704738 372.1871479 872.0379431 1004.888286 562.7596728 183.4500036 35.74114038 273.5018225 200.8650561 11.44406823 198.7552605 538.7054296 497.4129026 472.8560996 361.2024764 3.32_361.2025m/z 3.32 2065.955097 1031.923223 398.7952245 13660.39791 3850.98266 16163.30356 2456.37824 1422.197811 2752.821121 5138.745588 4101.725014 10146.61438 4944.259899 4621.234895 5048.532246 230.9978482 3.27_232.0051n 3.27 1809.002787 763.7556192 2054.166966 1233.953103 1344.089436 2675.112331 1954.330828 1648.212367 1648.706165 2772.709398 1291.851858 2809.457961 1754.054664 2059.323356 2027.217357 151.0411692 3.27_151.0412m/z 3.27 634.2030716 330.3004536 703.2880376 437.4630564 393.6457136 530.0578743 716.5189857 612.0324762 561.5016956 907.0762145 454.5841737 864.9076965 584.2594666 672.8939688 594.1045491 107.0493706 3.27_107.0494m/z 3.27 164.5246639 69.66449519 139.9603689 102.0148987 123.0543384 69.16294776 182.312518 208.3443171 148.5506367 194.6255677 131.3146074 181.8324317 109.0678753 156.5498602 115.7033039 235.1018379 3.32_235.1018m/z 3.32 246.1149709 253.8604013 318.5843501 217.1375672 201.3634653 262.9641573 248.6225943 192.313155 192.9907087 237.5943704 52.6939046 197.5679997 231.6270608 246.5609299 227.4874598 263.0953254 3.34_263.0953m/z 3.34 59.22226245 32.82604988 21.51291707 83.99149284 66.48334188 59.81618568 38.69339239 29.31419221 30.511189 50.85683596 5.835095805 19.42766958 21.79881654 33.1005606 22.34382199 101.0612755 3.34_101.0613m/z 3.34 43.8422548 20.73593751 37.81874852 33.465007 59.24988094 25.80437319 76.3394931 56.35524187 29.89618859 77.48503041 32.68835248 32.49091308 42.19065632 38.64778141 36.44293593 147.0667515 3.32_147.0668m/z 3.32 202.4373819 250.7280032 271.9929432 250.3269508 249.5088874 195.949469 190.0304636 219.0905292 192.4801472 280.9237834 340.7406968 224.4685721 225.080629 210.5856659 239.1558438 283.1555757 3.32_283.1556m/z 3.32 344.5458728 416.6753518 427.623842 350.8022593 324.7693146 357.0051554 508.4992799 407.4234093 468.5787226 503.3582569 271.1806662 422.6017177 436.1806826 364.3223813 400.1330878 251.1130993 3.32_251.1131m/z 3.32 40.31159055 6.904070891 10.46599717 28.07103285 20.78272346 46.40813574 0 0 5.806866156 15.22751507 0 10.6218477 11.26814015 9.129232052 17.69372873 164.9875531 3.20_164.9876m/z 3.20 187.2929562 48.26150665 68.10077113 38.71774962 92.70199493 158.9392105 95.9912758 85.0031016 32.3967257 85.65064181 12.06058478 67.8789531 108.2500905 110.7730155 84.45356297 201.0110051 3.22_201.0110m/z 3.22 427.4157452 349.0332984 397.9969628 184.606595 413.0714208 570.2033822 190.8556638 165.0047051 301.6258265 132.9176239 32.54394093 468.4468407 341.2633676 384.4363113 333.5771078 334.1645203 3.22_334.1645m/z 3.22 10.228243 171.3128269 98.20146182 65.10996997 58.31799382 26.65151476 209.4431731 204.9121262 110.0299642 235.0105505 93.49047477 206.1550896 94.30131403 143.8588475 182.9926906 337.040239 3.19_337.0402m/z 3.19 12.41557762 81.5655745 116.707945 23.91727887 71.56203634 142.5781907 11.679468 69.62663772 42.28938793 71.80175667 15.81330552 82.29302068 65.20425508 69.42872969 71.97773492 264.0015182 3.20_264.0015m/z 3.20 1624.851784 892.5398123 1079.975825 444.5004906 1074.921701 2389.62643 435.958726 319.0394401 693.2822843 395.0016084 143.2516083 1199.510136 1033.543161 1087.245316 946.1564861 272.0974424 3.20_272.0974m/z 3.20 921.8424718 418.153427 260.5613681 552.9424077 441.0500207 1647.244507 355.2614628 290.6186012 323.6769769 697.5237493 171.2832994 505.2605042 659.965377 799.5895175 663.7628919 103.0407138 3.24_103.0407m/z 3.24 144.0025824 143.2433649 97.36814315 155.5170193 143.1313326 212.7859265 128.6926298 88.23796926 87.5214887 165.3320895 115.8250756 111.1626937 153.9919399 148.1110827 160.0612734 159.0314405 3.26_159.0314m/z 3.26 144.9486521 194.1611126 211.2556692 278.1445375 208.7954822 216.8706978 188.1913103 127.2291819 207.3496995 270.2761983 189.416434 240.7590709 214.1325778 174.2621802 216.2475812 301.1474182 3.26_301.1474m/z 3.26 105.3840188 82.10721103 146.8681661 61.14203926 70.85028903 84.54633368 111.6773674 106.6741799 66.04157776 307.8546004 86.3877355 130.1314206 115.2489162 172.98544 144.0331841 189.1131884 3.24_189.1132m/z 3.24 347.0147179 322.3635636 458.4671957 318.3247461 172.4992892 298.4193606 353.1593032 334.2333164 248.4202858 486.7081212 470.152538 426.4280515 361.6823785 318.5475185 377.0594021 287.1374445 3.24_287.1374m/z 3.24 262.3059568 212.6303041 269.0457191 205.6976075 197.1950734 178.7625396 254.5927403 228.881672 171.3996478 440.3911744 125.5610144 227.1820357 269.9172645 311.2950427 262.1237593 307.0592218 3.24_307.0592m/z 3.24 93.6478617 70.34854758 318.1973145 69.49252818 40.11137142 34.42758959 107.2895386 145.3652598 261.9627143 194.517913 0 99.63304346 103.8209947 123.6082264 104.8381958 207.0860088 3.49_207.0860m/z 3.49 330.4256349 203.8464976 289.6265609 344.1486765 318.3167278 224.959948 139.9202415 104.2338104 230.2190225 157.4406298 106.6621302 192.8637906 256.0688831 235.1328151 226.9709405 223.0888657 3.51_223.0889m/z 3.51 253.5639013 171.923072 270.0186704 272.9196412 145.898214 389.9108903 75.18266726 83.23751352 154.602908 163.2445898 7.121828379 241.7384845 202.7004585 190.9433418 195.4291252 402.2210536 3.51_402.2211m/z 3.51 216.0029255 209.8186037 151.1998299 557.0252564 483.4064417 496.608132 181.5968634 32.67571319 125.6289801 229.3947081 0 94.60562759 323.3639923 319.1669522 289.3573234 112.0410978 3.44_112.0411m/z 3.44 32.4389439 26.19590859 37.83172717 32.19312757 29.00267024 77.51517312 164.6148358 118.5890613 153.3846261 213.68958 214.1103186 193.3056347 93.70156281 95.52851494 93.40943242 279.1286715 3.44_279.1287m/z 3.44 53.77269033 35.63322793 79.44579719 81.12960115 93.79012105 85.13651212 73.29583194 71.39874414 44.05423253 79.41646387 102.1020058 57.4435285 77.68911114 86.90424781 89.71857689 248.0973521 3.48_248.0974m/z 3.48 433.0599217 215.5154992 112.8028354 368.4991137 267.7192097 677.9328645 132.7063979 76.69295912 186.9298235 247.0863103 14.36346678 209.8493082 283.3199605 278.1938367 241.8827431 211.0616301 3.55_211.0616m/z 3.55 133.6190546 19.5788623 36.58844501 123.4512998 89.17083241 74.02133751 145.5982933 60.96260804 113.5324961 40.14229841 105.4293897 111.745168 77.46911052 79.24785568 79.9849738 246.9919406 3.56_246.9919m/z 3.56 11061.00733 13530.30499 19601.24325 11412.78274 8267.079707 7463.007231 9800.537633 12003.62887 13174.57365 18549.75541 8532.228432 16100.09599 13592.59768 13366.4396 11401.22333 167.0352311 3.56_167.0352m/z 3.56 1850.753782 2379.000077 3489.125246 1936.042636 1484.643803 1299.047439 1718.592712 2104.705973 2261.020902 3190.370927 1670.638897 2787.800166 2348.191962 2396.550247 2031.755579 289.1668985 3.53_289.1669m/z 3.53 223.3285643 422.7852751 459.738334 482.8779294 479.2547806 260.9405937 355.5630002 225.7730008 366.8692556 394.2900255 398.2440496 493.0211015 347.6053604 338.7365618 390.1355918 156.0669529 3.53_156.0670m/z 3.53 206.4009733 115.4765105 112.074168 148.94225 146.095435 160.7232167 197.4693263 161.6130857 146.6292217 188.424958 268.7063427 176.7594893 154.2888661 164.9861325 167.9216908 217.1092331 3.55_217.1092m/z 3.55 265.3603467 259.1107263 200.3244546 262.4669344 291.5654238 256.9471366 297.6195837 218.7588611 208.8678483 210.8379191 200.0448602 222.5175222 240.7857063 221.7660403 237.9710018 367.1859034 3.37_367.1859m/z 3.37 178.7587445 9.06651714 11.11908141 201.1944038 109.1266098 153.9572174 28.99990066 4.760678939 21.52265301 43.1411065 12.4464579 66.64292773 69.03172155 69.41112854 62.46848543 178.9796993 3.37_178.9797m/z 3.37 206.1829358 95.26248079 287.0206952 209.209904 117.7821654 169.9073093 158.365046 192.9256411 141.515613 177.9330357 145.4436902 172.9227314 213.729712 197.2255923 193.7205984 219.124427 3.39_219.1244m/z 3.39 259.0041092 291.9959164 305.2148035 309.4333472 227.8301869 218.7500432 205.3487156 183.9426662 202.2251111 316.7456563 165.7275778 244.4540546 251.7385663 239.3569217 252.1850461 74.02489479 3.37_74.0249m/z 3.37 1223.636934 314.0626365 208.7750387 1625.564951 1013.312619 1110.917444 437.703989 221.2629001 406.4103697 352.4994674 317.4883477 407.1143549 676.4438643 693.1365356 685.1123432 128.1090578 3.37_128.1091m/z 3.37 182.457091 23.17942017 11.88974496 190.5073604 126.1785792 180.8277719 52.34549354 3.748919066 39.9364058 42.56189312 34.58995741 76.19037861 98.38350152 84.61957808 96.86660243 268.1561074 3.37_268.1561m/z 3.37 252.3851552 237.1445921 183.1906494 324.6082875 277.1098559 381.8600929 155.9026285 80.57671402 145.0974171 200.5502019 41.39743317 192.4420544 201.8280739 227.914575 208.59752 186.0414872 3.44_186.0415m/z 3.44 202.9268656 221.7918223 228.7133123 212.6791911 240.4207189 573.6042001 931.8471643 679.8578602 931.4666762 1219.395938 1148.00477 1177.570564 564.5319832 565.7623906 547.785005 142.0519554 3.44_142.0520m/z 3.44 54.83269988 64.8972183 62.79189078 84.20825289 101.2328036 165.6649783 384.0730262 289.3734159 388.282019 479.9369376 443.0164385 483.0769939 215.6582901 218.1257829 208.4064771 214.1094169 3.44_214.1094m/z 3.44 1351.428142 217.1742591 288.4154819 942.5622925 632.0077555 653.4181133 308.2316728 173.9460471 314.7798904 389.6545242 201.3236189 318.4280008 519.2725895 504.4284507 551.1719985 232.9770014 3.41_232.9770m/z 3.41 6433.837146 3824.722942 4419.366853 2045.383054 3776.395892 2874.743247 1772.999084 2912.280251 8926.028731 3307.278897 1493.502807 10691.35307 4582.689404 4403.066483 3930.216521 153.0202418 3.41_153.0202m/z 3.41 1149.231429 723.495685 832.4921732 478.7867645 677.9041706 575.229505 399.2514801 648.8382629 1798.227866 695.2124629 331.740719 2456.341083 932.9171236 884.6191337 830.6758888 222.992736 3.43_222.9927m/z 3.43 756.4319225 1096.635427 6749.6212 680.5054892 264.4645712 162.6949415 845.9678189 481.3218704 437.5039753 606.6895349 315.1689653 1020.742448 1267.861367 1259.873967 1154.480902 71.01394272 4.25_71.0139m/z 4.25 103.1548123 2.357089761 59.68828726 45.69098114 23.47330933 38.86037534 114.3653671 87.2413038 190.8222796 184.0923372 85.92280745 190.9133062 126.6773148 116.4778378 119.7235327 112.9887256 4.26_112.9887m/z 4.26 371.8031861 3.766669012 156.2376437 131.4190891 84.5831899 99.52529635 440.0288814 405.3936925 654.7745289 600.8676864 451.5004029 596.7183474 391.8143442 388.6015808 365.0911136 99.00929871 4.26_99.0093m/z 4.26 260.1988622 11.96602403 139.7107857 120.2997984 81.82096031 100.9913289 325.2124873 267.4029687 511.5608073 439.3725951 291.9008132 455.2850441 298.075422 287.6178162 316.5428411 209.0141631 4.25_209.0142m/z 4.25 99.49102961 218.1664032 152.5834696 29.7642842 152.5157277 206.9974834 149.8913055 161.4054379 19.28366991 63.9367887 19.00544936 40.43320579 119.8188505 147.2209364 119.094421 222.0277997 4.25_222.0278m/z 4.25 198.5860859 141.1277603 367.7255024 211.175069 161.0959485 164.3640196 147.3071446 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