Matlab Matrix ID Compound Neutral mass (Da) m/z Charge Retention time (min) Isotope Distribution Blanks AVG S/N Mean STDEV CVB CVB>2CVT p<.05 # Detected d.f. t-test p value TBI AVG Control AVG TBI STDEV Control STDEV TC7 TL3 TN3 TI7 TK3 TE7 TF7 TG7 TH7 TO3 TA7 TB7 TD7 TJ3 TP3 TM3 SA3 NA8 SC7 SA7 NA6 SB3 NA2 NA4 SC3 NA3 NA0 SD7 NA9 NA7 NA5 SD3 SB7 NA1 1 9.56_788.5446m/z 788.5445654 1 9.555666667 100 - 40.9 - 7.78 - 0.146 0 #DIV/0! 328.5396941 76.57170637 0.116533417 1 0 34 18.68632923 0.400652994 0.693391232 327.0063678 316.2564489 73.02417883 83.4214925 396.083571 184.8936504 367.7212039 308.1283723 267.810077 313.4639325 284.2155794 323.5805133 322.5661462 289.0631558 427.3420414 405.7873139 428.7295813 255.7368007 243.8987219 413.0812246 197.6284594 350.8242013 309.3021962 276.3474188 389.5372694 224.3440823 329.1320991 404.6115349 258.2925413 330.2592794 410.8677553 231.2896417 419.8186704 424.8725843 377.0732117 191.3757979 194.3005963 372.73874 2 9.49_812.5453m/z 812.5452874 1 9.48805 100 - 39.7 - 3.08 0 #DIV/0! 155.8356274 71.52065381 0.229474656 1 0 34 19.22872877 1.444808523 0.16480249 142.6496714 126.6578042 27.71002859 36.62492569 151.0181171 138.8111526 164.2311901 162.8454806 122.9616706 97.29791553 173.9442881 200.0644175 137.0693349 126.7988481 175.4996394 127.6787934 152.4471236 128.7742694 114.7446397 108.2078614 110.1544832 164.1538262 124.7513154 98.35869005 185.4734731 113.8491018 150.7893647 159.9529195 153.3939574 131.2634416 135.892469 82.3962968 141.6774812 123.3174382 114.1629449 125.9604478 19.41587291 144.8769519 3 9.44_800.5438m/z 800.543818 1 9.437333333 100 - 37.5 - 1.98 0 #DIV/0! 374.5111023 137.8732752 0.184071012 1 0 34 19.07385522 0.713657224 0.484114127 351.3362061 328.1315606 90.15951617 99.42512748 425.2078539 174.4449481 420.8645857 294.2622593 260.9256937 349.5340324 359.9888414 392.8170162 397.0181127 236.208797 440.752475 425.2170567 462.2547062 286.1519199 243.5863791 452.1446205 222.944636 417.5508519 346.1938898 284.8837305 420.4085924 216.6727469 308.2901523 410.7815306 306.4586208 432.3821021 455.3038661 222.8440517 416.1495873 356.0598865 326.1290086 197.9965346 123.8611867 441.4571167 4 9.47_826.5586m/z 826.5586246 1 9.471133333 100 - 45.6 - 12.2 - 1.48 0 #DIV/0! 1598.956074 476.4702582 0.148994167 1 0 34 20.63495162 0.12153968 0.904476452 1542.759593 1563.009245 446.7889984 524.4839935 1683.838893 465.2536827 1614.704964 1410.654926 1384.91713 1532.269227 1412.372223 1248.664312 1506.267998 1458.101797 2462.962259 1860.360437 1854.961174 1125.326976 1466.134386 2197.363097 1436.698957 1608.170341 1225.972391 1443.490811 1555.691538 848.0491208 1672.604199 2078.354857 1050.979945 2041.457205 2399.430195 975.7523301 2314.184592 1917.224829 1821.980639 918.1328864 709.9656247 2116.025948 5 9.62_876.5755m/z 876.5755178 1 9.6233 100 - 44.7 0 #DIV/0! 414.7642636 213.3431052 0.257185978 1 0 34 25.4065061 0.825691422 0.416789367 378.3677276 340.0538175 107.5761456 160.4299625 325.5961842 269.3086563 539.2217748 448.8438085 266.4736619 365.0571255 527.6228357 567.9113075 417.671428 260.8806814 493.2693278 333.4265833 314.3238771 298.1986854 374.4147099 251.6629939 171.0976945 469.2964501 293.3344368 286.149959 685.3265379 178.9625268 383.5094564 456.5242465 238.0467815 404.1337006 413.6712029 117.8204842 433.1568795 400.6398594 410.903732 270.1876582 8.896500452 499.3106081 6 9.66_909.5493m/z 909.5493031 1 9.657116667 100 - 45.3 - 9.02 0 #DIV/0! 251.9398273 111.5449416 0.221372188 1 0 34 25.64896271 0.429944062 0.670919692 218.5388031 230.9963097 97.73134719 66.07776242 131.8016335 365.6255519 291.9546116 130.3456665 139.5232331 159.5102966 226.9805961 273.7546061 319.8273682 135.0813458 274.2357475 118.1596065 121.6322448 223.4650778 429.0733513 155.6499119 270.7830841 261.3018515 185.6994005 266.3130256 336.9682255 270.4910724 153.5644315 316.1037172 256.0438823 271.444567 267.9818421 125.9028064 160.9500699 122.0616508 296.6842529 185.979172 164.5982259 245.0622976 7 9.61_747.5650m/z 747.5650369 1 9.606383333 100 - 45.3 - 11.7 - 1.59 0 #DIV/0! 4396.889417 810.0966131 0.092121559 1 0 34 19.19565924 0.638685016 0.530652267 4288.297661 4474.674687 718.1992343 975.9649734 4054.890934 4544.005675 3577.967616 2920.673426 5062.659712 4229.422661 3582.969971 3584.754323 4715.692196 5456.849244 3674.391456 4538.774581 4614.429622 5486.597297 4042.841427 4525.842437 5114.066735 3955.304599 4324.464493 4320.768585 3410.298144 5186.622015 4185.348303 3615.07526 5645.432943 3455.001766 3717.267979 4851.065107 4193.856643 4213.671198 3561.319041 4789.333508 7439.671969 4565.576069 8 9.59_850.5597m/z 850.5596634 1 9.589483333 100 - 51.3 - 15.2 - 2.77 - 0.335 0 #DIV/0! 5411.04244 2453.183065 0.226683037 1 0 34 20.65118613 0.523255917 0.606545689 4567.30196 4760.888532 763.3567583 1344.6881 4307.130347 3767.719657 5091.477469 4898.603466 3348.923774 4142.291476 5337.378514 5665.308308 5140.014621 3525.082193 6025.893942 4645.041746 4773.473579 4061.494276 4294.289308 4052.708688 3881.47617 5129.709319 3965.422297 3659.747294 6735.584363 3573.89329 4982.295119 6712.52146 4514.602976 6414.411518 5157.038511 2890.33137 5534.595007 4421.498473 5348.964022 4039.251811 2078.513447 6656.137127 9 9.59_918.5474m/z 918.5474242 1 9.589483333 100 - 34.1 - 1.33 0 #DIV/0! 80.16848392 41.74359896 0.260349185 1 0 34 25.79676043 0.401264944 0.691634375 66.95498632 70.472564 20.33345263 30.30031831 59.81042373 71.51833261 98.62753779 82.49577609 41.84025585 61.17808014 81.67676934 102.5594922 82.64915341 39.57317823 86.48479854 54.34451973 63.00079251 52.09032565 55.20835163 38.22199365 57.77894885 88.37171516 55.45845641 50.78487402 122.3423624 50.15217304 86.2040802 122.597217 56.504801 97.94846508 74.4836862 28.3243654 90.57121423 50.74500023 75.4347642 51.55904206 9.761833859 99.48315273 10 9.27_874.5596m/z 874.5595838 1 9.268266667 100 - 48.4 - 9.9 - 0.465 0 #DIV/0! 482.4624845 203.2531956 0.210641451 1 1 34 21.20901054 2.787666243 0.011030306 482.7237798 377.353953 67.54024861 143.4757559 426.7895202 506.6213666 506.3668377 535.7274594 522.8405501 376.3314279 612.9422938 497.2513144 473.4014378 521.9738225 567.7136707 439.313844 450.3341596 490.1329811 448.1095439 347.730247 381.6797297 490.1672734 235.3333989 368.7998856 523.5054953 226.0532512 472.7251423 510.2990548 356.7841248 401.7158486 408.1868423 111.5008498 432.9233203 451.1916605 434.7224285 499.826298 8.299584007 478.6569656 11 9.29_857.5187m/z 857.5186754 1 9.285166667 100 - 44.7 - 11.8 - 0.559 0 #DIV/0! 566.3090348 118.5013981 0.104626088 1 0 34 18.65139313 0.175414744 0.862711963 549.1456117 542.6839556 94.73622119 119.6988286 574.3612719 366.7395292 504.3487888 420.1950506 469.9148632 552.7881303 581.5488197 519.3722366 569.5498304 534.2018913 591.6534356 634.8281297 646.0649168 675.3430442 435.530282 709.8895669 464.2753547 510.2618788 438.0363574 446.9519888 556.3082732 392.9519936 504.6869264 660.3372905 571.1239716 694.4209596 651.6300897 358.8382785 660.3485096 621.8903609 721.306187 415.4734103 407.3291524 692.1402183 12 9.29_774.5293m/z 774.5292893 1 9.285166667 100 - 35.6 - 2.01 0 #DIV/0! 112.6832807 39.51768526 0.175348486 1 0 34 21.74538453 0.250517622 0.80462177 109.5380087 106.2016991 33.60012075 43.84511537 122.4451495 36.57298182 155.8366963 101.8132879 71.23582924 98.61048703 131.5094438 119.2797938 127.2435933 75.7910889 139.4314028 128.1646755 131.5534527 95.25187315 65.95590763 151.9124758 55.98894518 154.8521989 107.3818723 119.5659337 144.3463821 35.23382016 85.69858945 143.9131208 79.08974284 142.6622796 191.2207228 74.90080874 100.6548056 119.7065911 115.7182292 48.50498887 45.25666196 146.9348908 13 9.22_798.5282m/z 798.5282407 1 9.217533333 100 - 35.9 - 2.53 0 #DIV/0! 123.3366905 67.79514007 0.274837681 1 0 33 26.67689312 0.55837522 0.581365416 110.0099279 101.4947647 38.27954606 50.37437799 93.58252414 58.63639135 147.5110278 126.1682523 83.02348883 99.37755541 196.2569855 152.8782777 141.2378131 83.03991697 143.2412388 90.99497237 96.71822313 112.5146504 54.8738395 80.10368865 60.31191053 177.1179122 109.1963188 133.4605039 153.8030453 29.33752749 106.6350925 134.5280994 91.20365191 149.9630183 178.0470868 55.0737141 80.2332868 75.31657505 105.9949659 51.38691269 0 135.2961427 14 9.08_745.5498m/z 745.5497973 1 9.082283333 100 - 41 - 7.77 - 0.0876 0 #DIV/0! 723.9690002 107.94644 0.074551839 1 0 34 17.75577495 0.302129819 0.766218195 696.4517603 705.8581794 87.8175833 93.65688435 665.6016968 740.4810657 665.5255459 516.082477 757.3833493 658.8077064 594.2977806 639.9345271 781.4732981 793.1786754 657.877873 716.7733794 728.2003569 892.6824888 646.7394658 688.1884785 909.9722052 775.8948821 630.7501586 699.2781126 654.1021362 652.2824526 654.6620008 702.1801322 847.6501402 572.6691415 697.3782489 632.6033464 762.0795336 671.6114174 548.6001742 701.6376832 801.0100143 791.0854497 15 9.08_824.5450m/z 824.5449962 1 9.082283333 100 - 30.2 - 1.27 0 #DIV/0! 89.25941029 47.04058965 0.263504932 1 0 34 21.12943434 1.110214122 0.279458065 87.20523659 72.4663076 37.42976179 39.9538596 120.0406404 12.22634947 125.288062 90.22846906 60.98846434 62.40724607 65.61387003 68.63084449 77.20629263 49.41528917 146.808863 108.8082615 119.7266933 50.81119823 97.94475843 139.1384833 56.2783079 93.46357709 51.55675645 82.21856558 88.17743785 16.13002099 87.20442083 126.0226936 44.50161124 86.20849523 130.2430189 18.37066112 139.1102224 58.9047343 92.71549511 32.5303315 2.657610161 98.09957664 16 9.17_881.5194m/z 881.5193717 1 9.166816667 100 - 33.5 - 2.7 0 #DIV/0! 65.91874642 38.13424855 0.289251925 1 0 34 29.83265675 0.611733617 0.5454804 53.31258296 58.61400301 12.23949939 34.39957297 51.49368125 28.22456314 75.88874911 38.09384031 42.70014148 55.91938557 56.17819924 75.55105908 62.85789042 45.6401563 59.81686408 53.29045037 52.8976784 52.77169979 55.62891784 46.048051 30.39702384 75.52257717 48.99048025 41.9974804 108.0456298 18.96799985 39.4458997 118.6033955 55.97712743 93.82848634 76.42067619 6.523821003 67.46584687 50.28738022 97.38223 31.28854523 3.7239833 90.18347112 17 9.40_824.5453m/z 824.5452542 1 9.403516667 100 - 43.9 0 #DIV/0! 546.7548687 189.2993204 0.173111692 1 0 34 19.34911284 1.055247135 0.304546674 519.2928547 475.6138354 105.4767333 135.3649644 543.4525506 285.0535155 640.455995 409.8528879 435.6150218 599.2355119 613.3749554 532.0052265 645.4609319 442.50272 601.4997737 542.3540711 548.0353794 502.0007396 362.1792587 605.6071362 335.5631673 614.1246124 522.452126 510.9543177 591.965221 288.4420267 431.9212787 576.731414 365.8573179 694.9401992 622.5281987 352.770898 524.0441264 552.8120096 438.4856674 259.4631185 276.7554394 601.2378985 18 9.81_864.5774m/z 864.5773612 1 9.812133333 100 - 37.1 - 1.8 0 #DIV/0! 55.5381824 27.58235822 0.248318878 1 0 34 28.34512809 0.088467148 0.930135119 48.12359378 48.68387744 18.93340741 17.85204537 29.65924288 59.38173325 79.0263916 73.96254807 29.04438881 32.99487572 47.91301208 72.63303543 59.02181152 27.65434127 60.06246307 28.87456048 30.82062727 40.61337821 67.65602685 30.65906391 32.01153387 58.07059989 44.79533115 43.1976627 88.01352671 58.82004431 56.66658296 78.01718359 46.66685023 58.75490965 45.13355919 22.77437001 38.18232867 23.51345211 54.68835492 51.36530394 20.20898219 55.42921789 19 9.80_911.5638m/z 911.5637687 1 9.795233333 100 - 34.4 0 #DIV/0! 42.55878458 29.70191186 0.348951599 1 0 34 29.95938465 0.920395225 0.364959615 31.34650372 37.34468431 19.91670879 17.83856936 26.44899791 56.60209319 36.96454598 25.1022278 12.69101385 40.14683649 57.90352224 27.84161454 19.21831068 12.21216535 19.69820873 9.282300579 17.8542655 45.08082357 79.36212993 15.13500313 38.20615788 85.35880941 31.15831479 50.76509527 62.22724001 36.49074529 24.42079714 42.26390673 33.64544308 52.80821859 40.90321834 15.89589281 30.60905827 24.10634984 34.23498949 15.61581257 12.22985721 41.26441079 20 9.81_802.5599m/z 802.5598535 1 9.812133333 100 - 49.1 - 13.7 - 2.74 - 0.354 0 #DIV/0! 18570.77464 2580.259451 0.06947097 1 0 34 17.54440996 1.364882789 0.190083416 17605.61384 18749.70547 2600.805773 2244.492899 18800.76084 12252.1244 16208.68663 16096.78956 16115.38295 18371.6233 16620.1811 16835.93897 18484.14306 17264.9854 20214.93889 21224.23966 21741.08147 16052.66788 14352.61514 21053.66211 18736.17445 16976.14762 18065.25204 16228.32821 17862.41683 15516.1881 17960.37249 20095.5584 17607.31114 21068.00959 21616.36065 17429.36016 21788.44753 20727.5466 18873.04763 14548.21819 20068.66575 22327.29314 21 9.81_870.5474m/z 870.5474347 1 9.812133333 100 - 42.8 - 6.06 0 #DIV/0! 377.7432332 44.88565378 0.059412916 1 0 34 17.28765531 1.131830018 0.273419355 375.3570501 392.1237974 47.85792211 37.05965969 427.2093201 311.1269834 337.9362923 362.8491253 366.0743018 387.9514828 352.4890222 362.6269906 386.0901438 383.5608435 387.854361 423.2959423 458.4986271 334.4992558 279.7578052 443.8923052 409.2026752 330.1314111 378.5346941 363.2825729 382.8875191 376.4304818 399.0466137 396.6447225 384.3041669 435.0108389 440.8484255 391.3505601 423.4753967 434.8580986 345.0986694 316.1827622 441.4443771 409.4943674 22 9.88_761.5826m/z 761.5825932 1 9.879766667 100 - 27 0 #DIV/0! 54.08337032 20.94579628 0.193643593 1 0 34 27.13549849 0.049907694 0.960563323 55.19356837 55.56867133 20.26233638 23.55683137 42.43199461 110.2104446 61.10103049 43.49655531 67.06905691 51.70893263 27.00440832 47.28579006 59.63375977 71.44224867 31.81171649 38.23673682 37.22700706 68.45555557 67.91101687 58.07083981 71.44942106 55.06194468 44.63918562 51.57158061 42.97789846 117.6638874 51.08532988 54.32824839 80.48458995 39.16457146 21.38561989 56.18836586 41.24479124 30.77477829 30.2371077 81.78690245 82.7105706 47.48129038 23 9.90_764.5291m/z 764.5291217 1 9.896666667 100 - 37.4 - 3.28 - 0.154 0 #DIV/0! 256.2397875 282.266349 0.550785559 1 0 34 18.43451436 1.234457603 0.232906282 182.9225661 301.0037277 45.33249115 402.9683021 144.9692014 143.9312855 206.6348926 178.7607832 169.5187773 274.1643385 185.0307313 235.2387969 140.1871334 163.4754825 222.52757 134.9508547 111.5165883 190.8627222 251.5703413 173.4215583 154.9534446 300.7970221 206.3531977 158.5400581 286.7103561 174.3820893 126.8453149 189.6887467 196.1377058 159.0298313 177.041707 224.7404208 190.2167972 346.622829 1891.960795 106.317745 342.84924 184.879798 24 9.86_738.5081m/z 738.5080644 1 9.86285 100 - 37.5 - 50.3 0 #DIV/0! 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