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168094 77564 28107 115048 164792 168949 121804 114513 124602 99036 8.50_265.10 55172 33243 42046 48704 27310 53491 36591 49993 30031 37715 37707 8.54_145.06 38232 20332 8571 19560 9178 25921 12790 22680 14543 20153 14271 207750 137562 127408 172950 232284 193879 216311 222651 8.54_746.36 19561 21259 16630 22766 13794 44026 25169 29060 19448 23274 17759 8.55_345.18 3491 2124 19685 65535 39624 87146 49882 81786 49938 59956 58668 8.55_302.10 43750 41971 44678 34963 63400 52457 57129 43366 53848 38402 8.56_179.06 125925 113895 113103 111080 104503 112973 118715 113596 108689 115316 112867 2175 3715 6475 4758 5419 3640 6172 8.58_834.39 5696 4111 4512 5236 3515 10683 5309 9378 4361 4931 5125 8.58_995.50 22042 10616 16419 14935 8518 42751 14856 29495 11785 15753 13358 8.59_406.18 18524 11637 13618 17306 11228 26243 16581 24828 14632 15015 18916 8.59_720.30 10274 11350 5307 7418 7732 16850 11411 15109 8001 14040 8108 8.60_104.04 115925 110938 103309 108195 87881 180928 142170 153250 115279 131071 104284 33309 19269 23203 34581 22128 35830 31241 8.60_521.17 54726 47132 36238 33572 34041 27362 40928 32800 32901 31988 31773 8.64_267.15 5620 32065 14694 74050 31487 77798 33319 91150 57030 64511 73453 8.65_609.26 2229 11602 4726 17417 8194 12789 8380 18323 14820 16685 18187 8.65_499.25 14402 23650 19659 30925 15975 72381 26059 51276 27641 32145 27376 8.66_131.05 59651 58915 64707 67180 3222 101824 6144 89921 71120 81438 66504 65597 60568 25896 83890 89615 81890 57999 8.68_473.16 23968 24864 23155 26819 42055 34339 22006 23085 25160 8.68_399.05 14658 21656 18216 24395 14561 43163 26336 29192 22976 21215 17808 8.69_360.14 2394 2637 3253 2768 2036 12060 3178 5745 3173 4880 2638 8.69_488.16 255064 181450 177888 154576 109953 329686 213863 232575 118769 122576 131243 8.69_146.05 328130 218358 238092 204461 145028 467362 263209 314460 172034 193888 179198 17022 11768 7680 30168 34427 31921 27619 7654 8.70_586.28 5803 5292 4412 5898 4259 15115 5854 9700 5763 6565 5119 8.71_687.29 3733 11460 6545 14880 8322 15425 9991 10723 10197 8.74_387.12 53609 62432 49442 59407 5766 93229 72791 70596 41104 25630 48515 8.75_219.10 3147 6126 56956 15771 9566 40761 27195 24103 13782 18916 16736 8.75_561.22 3419 6381 35234 10734 7880 21514 18579 13209 7957 8809 11198 8.75_174.09 16786 3664 3737 3673 3040 4749 5056 4279 3557 4680 3572 57031 51068 67220 8.79_676.31 14687 10411 13201 15152 9291 33432 14518 22978 11700 12416 13286 8.80_341.11 41791 47252 36061 44483 31153 66371 53056 55500 34628 34834 37067 8.82_379.08 31282 30221 10347 11857 10073 16646 16452 14206 9094 7608 11198 5175 2014 2449 8.86_395.21 2599 3626 9470 18912 10784 24395 11943 21158 14406 16882 15586 8.88_359.16 3584 3429 10364 13170 9024 38843 13877 22819 12018 15936 11453 8.88_377.09 93127 101329 79247 95258 66522 106463 111113 102141 79551 93391 81883 13398 6014 3206 4516 2817 6697 4333 4342 8.90_517.19 3152 27765 13865 33280 17073 52931 26817 45779 25765 36288 27077 8.91_550.22 14688 23947 21390 26549 16926 76227 33490 49944 20707 31936 21656 8.92_387.12 223455 225339 185004 228413 156435 366384 272965 289395 202685 237254 192417 5105 8.96_523.32 7448 6131 6991 6355 4274 15649 6518 10948 6022 8449 5852 9.05_722.30 3731 5018 3567 5849 3903 21775 5378 10682 5353 6650 5374 9.05_524.25 7126 13774 13871 14902 11258 39598 15008 23861 13356 18378 14003 9.10_444.23 4664 15085 5096 20865 11076 36106 15458 29406 17194 18923 18459 9.12_317.15 8419 22166 15891 34734 19245 30919 21680 25467 21586 9.19_677.34 17954 17681 13262 20770 14044 45721 18228 33458 19526 22443 19375 9.36_154.06 29482 17874 15893 19077 13691 26960 20916 21038 14003 13750 15768 34763 20961 24668 53483 54538 45514 39371 36825 9.39_173.10 51811 51311 42419 49213 33201 78401 57779 58703 45064 56122 36445 76826 17393 44543 101820 83509 50085 37215 64306 9.48_225.10 61719 48866 83192 71238 28379 192169 63803 104422 60049 67132 55498 28009 16028 13136 5302 9644 24806 19292 19658 10.99_955.97 33605 2322 7252 2084 24730 13157 3067 45498 37637 40097 11.75_967.00 2130 41420 2193 2876 6425 2422 2975 2038 16254 2337 4444 3204 92515 62477 3047 2356 22743 2321 9011 11.78_955.97 21540 3181 9575 2350 2129 36539 21004 11745 4500 metabolite_name m/z RT 1.05_1175.78 1175.7757 1.053 1.13_188.99 188.9918 1.128 1.13_203.00 203.0024 1.129 1.13_473.28 473.2827 1.13 1.14_367.26 367.2602 1.139 1.15_421.23 421.2267 1.154 1.17_377.07 377.0702 1.168 1.17_226.02 226.0184 1.169 1.19_187.01 187.0075 1.185 1.20_279.16 279.1638 1.197 1.22_265.15 265.1481 1.218 1.22_309.17 309.174 1.224 1.25_144.05 144.0459 1.246 1.26_121.03 121.03 1.263 1.27_438.01 438.0082 1.269 1.29_215.04 215.0391 1.287 1.31_339.22 339.2192 1.31 1.34_150.02 150.0199 1.337 1.34_490.23 490.2283 1.343 1.36_522.25 522.2531 1.36 1.37_186.04 186.0413 1.37 1.37_341.20 341.199 1.37 1.37_339.20 339.1998 1.371 1.38_476.21 476.2122 1.377 1.38_508.24 508.2385 1.379 1.38_189.08 189.077 1.382 1.39_325.18 325.1842 1.394 1.40_307.07 307.0658 1.403 1.40_349.20 349.2031 1.404 1.41_311.17 311.169 1.407 1.41_637.36 637.3612 1.409 1.41_356.08 356.0815 1.413 1.41_639.36 639.3633 1.415 1.42_313.17 313.169 1.421 1.42_480.21 480.211 1.422 1.42_623.34 623.3439 1.422 1.42_659.34 659.3412 1.424 1.43_297.15 297.1526 1.429 1.43_609.33 609.3287 1.432 1.44_243.03 243.0335 1.435 1.44_293.15 293.1494 1.438 1.44_290.17 290.175 1.441 1.46_273.05 273.0451 1.458 1.47_240.00 239.9983 1.468 1.47_153.02 153.023 1.472 1.48_129.06 129.0554 1.485 1.50_262.14 262.1437 1.5 1.54_151.04 151.0409 1.539 1.54_137.03 137.0251 1.54 1.58_309.13 309.1258 1.578 1.59_249.15 249.155 1.589 1.62_245.05 245.0495 1.617 1.62_200.09 200.0933 1.623 1.63_325.13 325.1317 1.628 1.63_466.19 466.1928 1.63 1.65_156.10 156.1029 1.648 1.65_502.18 502.1767 1.652 1.67_519.23 519.2256 1.67 1.67_295.09 295.0871 1.672 1.68_354.24 354.2396 1.68 1.70_396.15 396.1497 1.703 1.71_428.19 428.1861 1.712 1.79_234.08 234.0784 1.793 1.80_186.08 186.0769 1.803 1.87_131.07 131.0711 1.866 1.90_259.11 259.1082 1.898 2.03_103.04 103.0388 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3.77_187.04 187.0432 3.77 3.83_147.07 147.0667 3.83 4.01_225.09 225.0889 4.013 4.02_451.18 451.1841 4.017 4.10_409.25 409.2466 4.1 4.11_122.03 122.0262 4.109 4.13_259.08 259.0802 4.132 4.15_309.10 309.1031 4.147 4.19_130.09 130.0895 4.19 4.19_173.09 173.0949 4.192 4.19_764.46 764.4573 4.193 4.19_835.49 835.4942 4.195 4.24_117.02 117.0203 4.24 4.24_780.45 780.4528 4.24 4.24_425.24 425.2423 4.244 4.25_354.21 354.2069 4.249 4.27_683.40 683.4003 4.267 4.28_754.44 754.4372 4.279 4.32_328.19 328.1892 4.32 4.44_668.30 668.2983 4.444 4.58_420.11 420.1148 4.579 4.58_422.11 422.1129 4.579 4.62_804.57 804.5745 4.618 4.62_802.56 802.5604 4.621 4.70_340.19 340.1881 4.696 4.70_681.38 681.3821 4.698 4.70_376.17 376.165 4.699 4.73_603.24 603.2362 4.725 4.76_262.04 262.0408 4.757 4.78_164.07 164.0718 4.781 4.78_207.08 207.0774 4.785 4.80_134.05 134.0473 4.805 4.80_649.39 649.3924 4.805 4.81_425.24 425.2406 4.806 4.81_570.29 570.2926 4.811 4.81_485.24 485.2405 4.813 4.83_487.23 487.2261 4.826 4.83_227.10 227.1041 4.829 4.87_130.05 130.0502 4.868 4.88_556.28 556.277 4.877 4.89_411.22 411.2246 4.887 4.94_621.32 621.3245 4.936 4.97_135.03 135.03 4.974 4.98_322.09 322.0896 4.978 4.98_195.00 194.9975 4.98 4.99_305.07 305.072 4.987 5.00_455.25 455.2494 5 5.00_274.13 274.1294 5.001 5.00_276.10 276.101 5.003 5.01_147.03 147.0307 5.01 5.01_174.02 174.0235 5.011 5.01_403.15 403.147 5.011 5.01_146.03 146.0292 5.012 5.01_471.17 471.1744 5.013 5.01_112.05 112.0512 5.014 5.01_490.16 490.1599 5.014 5.02_306.06 306.0647 5.019 5.02_279.04 279.0396 5.023 5.02_281.04 281.0381 5.024 5.03_536.31 536.3085 5.031 5.03_258.10 258.0988 5.032 5.03_379.10 379.1017 5.034 5.04_243.06 243.0637 5.035 5.04_418.09 418.0932 5.036 5.04_518.20 518.1973 5.037 5.04_487.20 487.195 5.039 5.05_304.06 304.0643 5.055 5.06_302.07 302.0672 5.057 5.06_372.16 372.1625 5.057 5.06_534.29 534.2909 5.058 5.07_570.24 570.2437 5.069 5.07_995.49 995.488 5.069 5.07_593.27 593.2693 5.074 5.08_266.09 266.0901 5.077 5.08_312.12 312.0959 5.08 5.09_326.17 326.1722 5.087 5.09_601.31 601.3058 5.09 5.10_374.17 374.1711 5.101 5.10_653.35 653.3505 5.101 5.11_701.35 701.3507 5.11 5.12_362.15 362.1491 5.115 5.12_364.15 364.1463 5.118 5.18_510.29 510.292 5.184 5.19_568.30 568.2985 5.187 5.20_508.22 508.2165 5.198 5.25_483.25 483.2465 5.245 5.25_241.12 241.1198 5.248 5.25_651.24 651.2449 5.254 5.26_586.34 586.3447 5.265 5.27_931.57 931.5712 5.266 5.27_390.22 390.2239 5.271 5.28_194.10 194.1034 5.276 5.29_484.25 484.2486 5.287 5.33_87.01 87.0097 5.325 5.33_308.11 308.1144 5.335 5.34_300.10 300.0999 5.343 5.37_260.12 260.1154 5.367 5.40_745.36 745.3572 5.404 5.42_757.42 757.4243 5.415 5.46_199.07 199.0733 5.457 5.46_487.29 487.2913 5.458 5.48_309.10 309.1031 5.478 5.50_290.12 290.1156 5.502 5.52_607.35 607.346 5.516 5.52_425.24 425.2411 5.517 5.52_328.19 328.1886 5.522 5.55_600.25 600.2511 5.549 5.55_457.08 457.0757 5.55 5.55_228.04 228.035 5.551 5.56_485.26 485.262 5.561 5.60_736.42 736.4244 5.598 5.62_380.07 380.0686 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1136.5186 7.075 7.08_586.34 586.3356 7.082 7.09_1098.56 1098.5622 7.088 7.10_498.20 498.2039 7.095 7.10_690.34 690.3363 7.101 7.12_227.14 227.1407 7.117 7.13_501.30 501.3045 7.128 7.14_458.26 458.2624 7.138 7.14_319.16 319.1624 7.145 7.15_273.16 273.1577 7.146 7.15_404.25 404.2519 7.146 7.15_615.32 615.3153 7.154 7.16_300.19 300.1934 7.155 7.17_282.09 282.0854 7.168 7.18_837.43 837.4342 7.176 7.20_551.29 551.2857 7.201 7.22_545.28 545.2829 7.218 7.23_652.37 652.3677 7.226 7.24_1122.62 1122.6194 7.237 7.24_749.35 749.3522 7.238 7.25_247.11 247.1129 7.254 7.26_633.33 633.3258 7.256 7.26_574.34 574.3374 7.257 7.26_453.24 453.2354 7.262 7.26_819.42 819.4244 7.265 7.28_803.38 803.3775 7.275 7.29_728.35 728.3457 7.29 7.29_903.49 903.4932 7.293 7.29_603.37 603.3711 7.294 7.30_534.30 534.2958 7.296 7.30_560.28 560.2771 7.301 7.30_1159.52 1159.5156 7.304 7.30_286.18 286.1779 7.305 7.30_615.34 615.3356 7.305 7.31_889.44 889.4351 7.305 7.31_657.31 657.3129 7.308 7.31_328.15 328.1523 7.309 7.32_322.15 322.1543 7.316 7.32_587.38 587.3759 7.316 7.32_670.41 670.4135 7.318 7.33_836.43 836.4318 7.331 7.35_516.25 516.251 7.347 7.35_484.27 484.2745 7.352 7.36_337.06 337.0613 7.361 7.36_387.22 387.2239 7.364 7.37_965.43 965.4309 7.369 7.37_812.44 812.441 7.37 7.37_998.48 998.4845 7.37 7.37_631.31 631.3148 7.371 7.37_492.26 492.2565 7.374 7.37_531.26 531.2566 7.374 7.38_448.23 448.2303 7.378 7.38_551.32 551.3176 7.378 7.38_638.35 638.3508 7.379 7.38_1185.60 1185.6019 7.382 7.38_148.04 148.0446 7.383 7.38_215.14 215.1404 7.384 7.38_427.26 427.256 7.385 7.39_415.20 415.2003 7.391 7.39_617.28 617.2795 7.391 7.39_356.18 356.1828 7.394 7.40_793.41 793.4102 7.4 7.40_722.33 722.3319 7.403 7.41_235.11 235.1095 7.412 7.42_1023.55 1023.5519 7.415 7.42_471.28 471.2791 7.417 7.42_429.20 429.2004 7.418 7.43_265.12 265.1201 7.425 7.43_529.30 529.2984 7.431 7.43_618.27 618.2721 7.435 7.44_686.34 686.3395 7.435 7.44_650.39 650.3883 7.439 7.44_470.24 470.2372 7.44 7.46_756.39 756.3943 7.462 7.47_470.26 470.2601 7.469 7.49_976.55 976.5459 7.486 7.49_661.41 661.414 7.49 7.49_330.20 330.2042 7.491 7.49_366.18 366.1814 7.491 7.49_544.28 544.2781 7.492 7.49_510.27 510.267 7.494 7.50_328.05 328.0467 7.503 7.51_368.18 368.1783 7.506 7.53_328.18 328.184 7.532 7.54_918.45 918.4463 7.54 7.54_322.12 322.1169 7.541 7.54_1077.59 1077.5942 7.544 7.55_393.19 393.1903 7.547 7.55_413.24 413.2401 7.553 7.55_696.39 696.3936 7.553 7.56_213.13 213.1257 7.557 7.56_215.03 215.0348 7.557 7.58_548.25 548.2493 7.577 7.58_409.25 409.2462 7.581 7.58_326.13 326.1268 7.585 7.59_657.33 657.3257 7.587 7.60_523.25 523.2531 7.602 7.60_332.18 332.1841 7.604 7.62_774.33 774.3324 7.622 7.63_553.23 553.233 7.632 7.64_231.14 231.1364 7.638 7.65_308.10 308.1004 7.65 7.65_473.21 473.2091 7.65 7.65_299.10 299.1026 7.651 7.65_602.29 602.2851 7.651 7.65_489.24 489.2365 7.655 7.66_128.04 128.0361 7.657 7.66_453.20 453.2003 7.662 7.66_367.17 367.1733 7.663 7.66_381.19 381.1891 7.665 7.67_187.11 187.11 7.668 7.68_495.19 495.1913 7.678 7.69_506.24 506.2377 7.69 7.69_180.06 180.0636 7.694 7.72_196.02 196.0242 7.72 7.72_225.06 225.0633 7.721 7.72_179.06 179.0572 7.724 7.74_199.07 199.0738 7.737 7.83_249.09 249.0926 7.834 7.83_440.25 440.2523 7.834 7.84_250.10 250.0954 7.835 7.85_353.16 353.1575 7.851 7.85_583.31 583.3101 7.852 7.86_173.09 173.0943 7.858 7.86_682.38 682.3784 7.86 7.88_243.06 243.0637 7.878 7.88_475.20 475.1994 7.878 7.88_215.07 215.0688 7.88 7.88_431.14 431.1437 7.885 7.89_559.27 559.2715 7.886 7.89_435.20 435.2041 7.893 7.89_666.35 666.3473 7.895 7.90_217.12 217.1206 7.896 7.90_967.00 967.0033 7.897 7.90_704.31 704.3096 7.9 7.90_1078.58 1078.5822 7.902 7.91_447.19 447.1937 7.912 7.92_640.33 640.3316 7.916 7.93_318.17 318.1682 7.929 7.94_259.13 259.1316 7.936 7.94_991.45 991.4534 7.944 7.96_256.10 256.0953 7.964 8.00_237.09 237.091 7.995 7.99_1006.56 1006.557 7.995 8.00_498.14 498.1405 8.004 8.01_385.06 385.0584 8.012 8.01_383.06 383.0603 8.013 8.02_854.43 854.4279 8.023 8.03_576.27 576.272 8.029 8.03_130.05 130.0546 8.032 8.04_258.15 258.1472 8.035 8.04_438.24 438.2362 8.038 8.04_517.30 517.2984 8.038 8.04_866.36 866.3624 8.038 8.04_203.11 203.105 8.04 8.05_412.22 412.2208 8.047 8.05_426.24 426.2368 8.047 8.05_672.34 672.3365 8.048 8.05_1099.58 1099.5775 8.052 8.05_573.27 573.2685 8.054 8.05_707.34 707.3362 8.055 8.06_750.91 750.9093 8.061 8.07_278.12 278.1249 8.075 8.09_245.12 245.1165 8.089 8.10_844.43 844.4306 8.097 8.12_626.30 626.2984 8.123 8.16_304.15 304.151 8.156 8.16_301.15 301.1501 8.161 8.17_560.24 560.2407 8.166 8.17_339.03 339.0319 8.174 8.20_288.15 288.15 8.2 8.22_744.34 744.3378 8.218 8.22_359.12 359.1204 8.224 8.23_267.14 267.1426 8.227 8.27_369.04 369.0436 8.268 8.30_628.31 628.31 8.295 8.31_753.38 753.3786 8.31 8.31_442.23 442.231 8.311 8.32_379.17 379.1719 8.322 8.33_420.20 420.1991 8.326 8.34_660.31 660.3114 8.344 8.35_569.29 569.2938 8.346 8.36_526.25 526.2519 8.359 8.37_866.39 866.3901 8.367 8.38_489.20 489.2039 8.377 8.38_413.07 413.0703 8.382 8.38_811.42 811.4204 8.383 8.39_260.13 260.1258 8.39 8.41_543.28 543.2787 8.405 8.41_544.27 544.268 8.405 8.41_729.40 729.4048 8.406 8.41_364.20 364.1997 8.407 8.42_580.31 580.3103 8.423 8.45_558.28 558.2786 8.451 8.49_164.04 164.0399 8.487 8.49_224.02 224.0245 8.492 8.50_265.10 265.0952 8.501 8.54_145.06 145.0623 8.54 8.54_746.36 746.3552 8.544 8.55_345.18 345.1788 8.547 8.55_302.10 302.1027 8.554 8.56_179.06 179.0567 8.561 8.58_834.39 834.3891 8.579 8.58_995.50 995.4951 8.584 8.59_406.18 406.1837 8.591 8.59_720.30 720.3049 8.591 8.60_104.04 104.036 8.597 8.60_521.17 521.1732 8.601 8.64_267.15 267.147 8.636 8.65_609.26 609.2627 8.648 8.65_499.25 499.2524 8.652 8.66_131.05 131.0466 8.663 8.68_473.16 473.164 8.675 8.68_399.05 399.0547 8.684 8.69_360.14 360.1423 8.686 8.69_488.16 488.1639 8.692 8.69_146.05 146.0465 8.694 8.70_586.28 586.2839 8.699 8.71_687.29 687.2947 8.714 8.74_387.12 387.1154 8.736 8.75_219.10 219.0993 8.75 8.75_561.22 561.2156 8.751 8.75_174.09 174.0886 8.753 8.79_676.31 676.3061 8.788 8.80_341.11 341.1097 8.796 8.82_379.08 379.0849 8.815 8.86_395.21 395.2055 8.862 8.88_359.16 359.1575 8.881 8.88_377.09 377.0866 8.881 8.90_517.19 517.1895 8.896 8.91_550.22 550.2162 8.906 8.92_387.12 387.1153 8.916 8.96_523.32 523.325 8.963 9.05_722.30 722.3008 9.048 9.05_524.25 524.2478 9.053 9.10_444.23 444.2292 9.101 9.12_317.15 317.1473 9.124 9.19_677.34 677.3377 9.186 9.36_154.06 154.0626 9.364 9.39_173.10 173.1048 9.393 9.48_225.10 225.0998 9.481 10.99_955.97 955.9717 10.994 11.75_967.00 967.0037 11.75 11.78_955.97 955.9714 11.775