precursor_mz	license	retention_index	authors	compound_name
362.18381	CC BY-NC	2520.736	Price et al., RECETOX, Masaryk University (CZ)	Acetylserotonin_2TMS isomer 2
489.1889	CC BY-NC	2566.364	Price et al., RECETOX, Masaryk University (CZ)	Acetylserotonin_TMS derivative
434.22321	CC BY-NC	2415.476	Price et al., RECETOX, Masaryk University (CZ)	Acetylserotonin_3TMS
362.18381	CC BY-NC	2475.613	Price et al., RECETOX, Masaryk University (CZ)	Acetylserotonin_2TMS isomer 1
136.05856	CC BY-NC	1443.328	Price et al., RECETOX, Masaryk University (CZ)	Methylnicotinamide
261.06659	CC BY-NC	1376.073	Price et al., RECETOX, Masaryk University (CZ)	Pipecolinic acid_2TMS
201.11786	CC BY-NC	1292.953	Price et al., RECETOX, Masaryk University (CZ)	Pipecolinic acid_1TMS
194.06293	CC BY-NC	1316.816	Price et al., RECETOX, Masaryk University (CZ)	Nicotinic acid_1TMS
362.16293	CC BY-NC	1664.769	Price et al., RECETOX, Masaryk University (CZ)	Ribose_4TMS
342.13101	CC BY-NC	1892.004	Price et al., RECETOX, Masaryk University (CZ)	Syringic acid_2TMS
367.16711	CC BY-NC	2118.982	Price et al., RECETOX, Masaryk University (CZ)	Guanine_3TMS
439.20303	CC BY-NC	2175.041	Price et al., RECETOX, Masaryk University (CZ)	Guanine_4TMS
260.14963	CC BY-NC	1282.975	Price et al., RECETOX, Masaryk University (CZ)	Leucine_2TMS
458.17902	CC BY-NC	1951.021	Price et al., RECETOX, Masaryk University (CZ)	Gallic acid_4TMS
396.16028	CC BY-NC	2131.329	Price et al., RECETOX, Masaryk University (CZ)	trans-Caffeic acid_3TMS
396.1604	CC BY-NC	1975.29	Price et al., RECETOX, Masaryk University (CZ)	cis-Caffeic acid_3TMS
525.24902	CC BY-NC	2071.766	Price et al., RECETOX, Masaryk University (CZ)	Acetylglucosamine_5TMS isomer 1
579.297	CC BY-NC	2081.004	Price et al., RECETOX, Masaryk University (CZ)	Acetylglucosamine_5TMS isomer 2
326.1362	CC BY-NC	1761.149	Price et al., RECETOX, Masaryk University (CZ)	4-Hydroxy-3methoxyphenylacetic acid_2TMS
278.12305	CC BY-NC	1317.247	Price et al., RECETOX, Masaryk University (CZ)	Glycine_3TMS
270.12137	CC BY-NC	1402.643	Price et al., RECETOX, Masaryk University (CZ)	Thymine_2TMS
348.1713	CC BY-NC	1658.764	Price et al., RECETOX, Masaryk University (CZ)	Asparagine_3TMS
368.1339	CC BY-NC	1499.852	Price et al., RECETOX, Masaryk University (CZ)	Asparagine_2TMS
420.21198	CC BY-NC	1598.743	Price et al., RECETOX, Masaryk University (CZ)	Asparagine_4TMS isomer 1
420.21072	CC BY-NC	1619.979	Price et al., RECETOX, Masaryk University (CZ)	Asparagine_4TMS isomer 2
320.15897	CC BY-NC	1782.981	Price et al., RECETOX, Masaryk University (CZ)	Azelaic acid_2TMS
319.14154	CC BY-NC	1960.418	Price et al., RECETOX, Masaryk University (CZ)	Indole-3-acetic acid_2TMS
245.10255	CC BY-NC	1919.926	Price et al., RECETOX, Masaryk University (CZ)	Indole-3-acetic acid_1TMS
355.1398	CC BY-NC	2119.143	Price et al., RECETOX, Masaryk University (CZ)	Acetyltyrosine_2TMS
426.17551	CC BY-NC	2085.942	Price et al., RECETOX, Masaryk University (CZ)	Acetyltyrosine_3TMS
518.24091	CC BY-NC	1900.622	Price et al., RECETOX, Masaryk University (CZ)	Allantoin_5TMS
446.20102	CC BY-NC	1877.684	Price et al., RECETOX, Masaryk University (CZ)	Allantoin_4TMS
374.16168	CC BY-NC	2065.527	Price et al., RECETOX, Masaryk University (CZ)	Allantoin_3TMS
252.10365	CC BY-NC	1988.727	Price et al., RECETOX, Masaryk University (CZ)	Theobromine_1TMS
473.1601	CC BY-NC	2310.707	Price et al., RECETOX, Masaryk University (CZ)	Glucose-6-phosphate_6TMS isomer 1
472.16409	CC BY-NC	2332.412	Price et al., RECETOX, Masaryk University (CZ)	Glucose-6-phosphate_6TMS isomer 2
434.21536	CC BY-NC	1936.412	Price et al., RECETOX, Masaryk University (CZ)	Galactitol_6TMS
422.21552	CC BY-NC	1713.998	Price et al., RECETOX, Masaryk University (CZ)	Ribitol_5TMS
363.17084	CC BY-NC	1611.723	Price et al., RECETOX, Masaryk University (CZ)	Glutamic acid_3TMS spectra 2
273.12088	CC BY-NC	1519.766	Price et al., RECETOX, Masaryk University (CZ)	Pyroglutamic acid_2TMS
285.13287	CC BY-NC	1528.459	Price et al., RECETOX, Masaryk University (CZ)	Glutamic acid_2TMS
460.40933	CC BY-NC	3195.161	Price et al., RECETOX, Masaryk University (CZ)	Cholestanol_1TMS
249.07844	CC BY-NC	1318.455	Price et al., RECETOX, Masaryk University (CZ)	Succinic acid_1TMS
598.29169	CC BY-NC	2734.555	Price et al., RECETOX, Masaryk University (CZ)	Maltose_8TMS isomer 1
624.3072	CC BY-NC	2762.246	Price et al., RECETOX, Masaryk University (CZ)	Maltose_8TMS isomer 2
292.13931	CC BY-NC	1366.752	Price et al., RECETOX, Masaryk University (CZ)	Alanine_3TMS
227.02199	CC BY-NC	1133.662	Price et al., RECETOX, Masaryk University (CZ)	Alanine_2TMS
232.07872	CC BY-NC	1772.129	Price et al., RECETOX, Masaryk University (CZ)	Indole-2-carboxylic acid_1TMS
273.11054	CC BY-NC	1223.943	Price et al., RECETOX, Masaryk University (CZ)	Aspartic acid_2TMS
415.03641	CC BY-NC	1722.841	Price et al., RECETOX, Masaryk University (CZ)	Aspartic acid_4TMS
300.2475	CC BY-NC	1839.995	Price et al., RECETOX, Masaryk University (CZ)	Myristic acid_1TMS
306.13684	CC BY-NC	1512.481	Price et al., RECETOX, Masaryk University (CZ)	Aspartic acid_3TMS isomer
333.15714	CC BY-NC	2080.405	Price et al., RECETOX, Masaryk University (CZ)	3-Indolepropionic acid
261.11783	CC BY-NC	2031.59	Price et al., RECETOX, Masaryk University (CZ)	3-Indolepropionic acid_1TMS
305.12579	CC BY-NC	2023.71	Price et al., RECETOX, Masaryk University (CZ)	Indole-3-carboxylic acid_2TMS
451.18115	CC BY-NC	1874.721	Price et al., RECETOX, Masaryk University (CZ)	Gluconic acid-1,5-lactone
466.20514	CC BY-NC	1888.373	Price et al., RECETOX, Masaryk University (CZ)	Gluconic acid-1,4-lactone
614.27368	CC BY-NC	1994.983	Price et al., RECETOX, Masaryk University (CZ)	Gluconic acid_6TMS
377.16287	CC BY-NC	1917.593	Price et al., RECETOX, Masaryk University (CZ)	Gluconolactone
208.0979	CC BY-NC	1456.937	Price et al., RECETOX, Masaryk University (CZ)	Methylnicotinamide_1TMS
466.22858	CC BY-NC	1877.592	Price et al., RECETOX, Masaryk University (CZ)	Mannose_5TMS isomer 1
448.21866	CC BY-NC	1895.569	Price et al., RECETOX, Masaryk University (CZ)	Mannose_5TMS isomer 2
376.19946	CC BY-NC	2384.715	Price et al., RECETOX, Masaryk University (CZ)	Melatonin_2TMS
304.15997	CC BY-NC	2445.713	Price et al., RECETOX, Masaryk University (CZ)	Melatonin_1TMS
543.21246	CC BY-NC	2564.368	Price et al., RECETOX, Masaryk University (CZ)	Inosine_4TMS
242.02328	CC BY-NC	1433.812	Price et al., RECETOX, Masaryk University (CZ)	Acetylleucine_1TMS
304.15579	CC BY-NC	1421.252	Price et al., RECETOX, Masaryk University (CZ)	Acetylleucine_2TMS
268.11243	CC BY-NC	1708.024	Price et al., RECETOX, Masaryk University (CZ)	Homoveratric_acid_1TMS
434.2149	CC BY-NC	1925.111	Price et al., RECETOX, Masaryk University (CZ)	Mannitol_6TMS
222.14323	CC BY-NC	1321.728	Price et al., RECETOX, Masaryk University (CZ)	Thymol_1TMS
406.18625	CC BY-NC	2212.521	Price et al., RECETOX, Masaryk University (CZ)	Tryptophan_3TMS
331.14139	CC BY-NC	2153.768	Price et al., RECETOX, Masaryk University (CZ)	Tryptophan_2TMS
378.10901	CC BY-NC	1733.549	Price et al., RECETOX, Masaryk University (CZ)	trans-Aconitic acid_3TMS
468.37778	CC BY-NC	3264.982	Price et al., RECETOX, Masaryk University (CZ)	Ergosterol_1TMS
277.10928	CC BY-NC	1421.292	Price et al., RECETOX, Masaryk University (CZ)	3-Methylglutaric acid_2TMS
396.19299	CC BY-NC	1707.47	Price et al., RECETOX, Masaryk University (CZ)	Arabitol_5TMS
413.3653	CC BY-NC	3300.418	Price et al., RECETOX, Masaryk University (CZ)	Cholestenone
434.21451	CC BY-NC	1932.941	Price et al., RECETOX, Masaryk University (CZ)	Sorbitol_6TMS
269.13876	CC BY-NC	1299.49	Price et al., RECETOX, Masaryk University (CZ)	Isoleucine_2TMS
464.2132	CC BY-NC	1861.884	Price et al., RECETOX, Masaryk University (CZ)	Fructose_5TMS isomer 1
555.26501	CC BY-NC	1871.707	Price et al., RECETOX, Masaryk University (CZ)	Fructose_5TMS isomer 2
249.05966	CC BY-NC	1350.603	Price et al., RECETOX, Masaryk University (CZ)	Fumaric acid_2TMS
468.15952	CC BY-NC	1801.269	Price et al., RECETOX, Masaryk University (CZ)	Isocitric acid_4TMS
204.09969	CC BY-NC	1246.784	Price et al., RECETOX, Masaryk University (CZ)	Urea_2TMS
276.15033	CC BY-NC	1199.655	Price et al., RECETOX, Masaryk University (CZ)	Urea_3TMS
643.29096	CC BY-NC	2761.007	Price et al., RECETOX, Masaryk University (CZ)	Guanosine_5TMS
371.18732	CC BY-NC	1914.512	Price et al., RECETOX, Masaryk University (CZ)	Histidine_3TMS
443.22736	CC BY-NC	2146.867	Price et al., RECETOX, Masaryk University (CZ)	Histidine_4TMS
421.19458	CC BY-NC	1640.562	Price et al., RECETOX, Masaryk University (CZ)	Xylose_4TMS
190.07045	CC BY-NC	1269.712	Price et al., RECETOX, Masaryk University (CZ)	Acetylalanine_1TMS
392.20975	CC BY-NC	1940.186	Price et al., RECETOX, Masaryk University (CZ)	Glycylleucine_3TMS
384.16013	CC BY-NC	1815.935	Price et al., RECETOX, Masaryk University (CZ)	3,4-Dihydroxybenzeneacetic acid_3TMS
476.27365	CC BY-NC	1870.232	Price et al., RECETOX, Masaryk University (CZ)	Glycylleucine_4TMS
318.15744	CC BY-NC	2098.84	Price et al., RECETOX, Masaryk University (CZ)	Indole-3-acetamide_2TMS
389.18936	CC BY-NC	2048.997	Price et al., RECETOX, Masaryk University (CZ)	Indole-3-acetamide_3TMS
520.3761	CC BY-NC	3290.675	Price et al., RECETOX, Masaryk University (CZ)	Lithocholic acid_2TMS
464.2132	CC BY-NC	1868.664	Price et al., RECETOX, Masaryk University (CZ)	Allose_5TMS isomer 1
402.17654	CC BY-NC	1895.068	Price et al., RECETOX, Masaryk University (CZ)	Allose_5TMS isomer 2
390.23691	CC BY-NC	2274.265	Price et al., RECETOX, Masaryk University (CZ)	Tetradecanedioic acid_2TMS
596.39124	CC BY-NC	3706.675	Price et al., RECETOX, Masaryk University (CZ)	Deoxycholic acid_3TMS
396.19266	CC BY-NC	1706.712	Price et al., RECETOX, Masaryk University (CZ)	Arabitol_5TMS
459.14395	CC BY-NC	1820.179	Price et al., RECETOX, Masaryk University (CZ)	Phosphoserine_4TMS
337.11273	CC BY-NC	1479.336	Price et al., RECETOX, Masaryk University (CZ)	Malic acid_3TMS
256.10553	CC BY-NC	1340.716	Price et al., RECETOX, Masaryk University (CZ)	Uracil_2TMS
555.25403	CC BY-NC	2626.723	Price et al., RECETOX, Masaryk University (CZ)	Adenosine_4TMS
627.2951	CC BY-NC	2694.825	Price et al., RECETOX, Masaryk University (CZ)	Adenosine_5TMS
324.98636	CC BY-NC	1925.08	Price et al., RECETOX, Masaryk University (CZ)	Acetylglutamine_2TMS
476.2366	CC BY-NC	1850.038	Price et al., RECETOX, Masaryk University (CZ)	Acetylglutamine_4TMS
308.15137	CC BY-NC	1526.173	Price et al., RECETOX, Masaryk University (CZ)	gamma-Aminobutyric acid_3TMS
401.98407	CC BY-NC	1744.992	Price et al., RECETOX, Masaryk University (CZ)	Acetylglutamine_3TMS
247.11795	CC BY-NC	1267.765	Price et al., RECETOX, Masaryk University (CZ)	gamma-Aminobutyric acid_2TMS
219.10622	CC BY-NC	1160.418	Price et al., RECETOX, Masaryk University (CZ)	Sarcosine_2TMS
262.10492	CC BY-NC	1226.577	Price et al., RECETOX, Masaryk University (CZ)	2-Methylmalonic acid_2TMS
273.12122	CC BY-NC	1518.258	Price et al., RECETOX, Masaryk University (CZ)	Pyroglutamic acid_2TMS
391.166	CC BY-NC	1654.213	Price et al., RECETOX, Masaryk University (CZ)	Acetylaspartic acid_3TMS
330.10126	CC BY-NC	1662.921	Price et al., RECETOX, Masaryk University (CZ)	Taurine_3TMS
508.25763	CC BY-NC	2081.314	Price et al., RECETOX, Masaryk University (CZ)	Acetylgalactosamine_4TMS
467.15692	CC BY-NC	1800.533	Price et al., RECETOX, Masaryk University (CZ)	Citric acid_4TMS
581.29388	CC BY-NC	2068.947	Price et al., RECETOX, Masaryk University (CZ)	Acetylgalactosamine_5TMS isomer 1
372.12848	CC BY-NC	1730.0	Price et al., RECETOX, Masaryk University (CZ)	Orotic acid_3TMS
434.20194	CC BY-NC	2091.044	Price et al., RECETOX, Masaryk University (CZ)	Acetylgalactosamine_5TMS isomer 2
373.20316	CC BY-NC	1808.72	Price et al., RECETOX, Masaryk University (CZ)	Arginine_3TMS
539.2533	CC BY-NC	3541.85	Price et al., RECETOX, Masaryk University (CZ)	Maltotriose_11TMS isomer 1
648.42804	CC BY-NC	3577.725	Price et al., RECETOX, Masaryk University (CZ)	Maltotriose_11TMS isomer 2
410.17297	CC BY-NC	1548.223	Price et al., RECETOX, Masaryk University (CZ)	Threonic acid_4TMS
325.00406	CC BY-NC	1383.911	Price et al., RECETOX, Masaryk University (CZ)	Threonine_3TMS spectra 2
334.17438	CC BY-NC	1884.285	Price et al., RECETOX, Masaryk University (CZ)	Sebacid acid_2TMS
312.11047	CC BY-NC	1599.903	Price et al., RECETOX, Masaryk University (CZ)	Hypotaurine_3TMS
333.12225	CC BY-NC	2064.473	Price et al., RECETOX, Masaryk University (CZ)	Kynurenic acid_2TMS
390.21848	CC BY-NC	1751.486	Price et al., RECETOX, Masaryk University (CZ)	Theanine_3TMS
318.1786	CC BY-NC	1767.969	Price et al., RECETOX, Masaryk University (CZ)	Theanine_2TMS
311.11298	CC BY-NC	1691.138	Price et al., RECETOX, Masaryk University (CZ)	4-Methoxymandelic acid_2TMS
404.23398	CC BY-NC	2099.177	Price et al., RECETOX, Masaryk University (CZ)	Acetyllysine_3TMS
476.27362	CC BY-NC	2062.792	Price et al., RECETOX, Masaryk University (CZ)	Acetyllysine_4TMS
298.28644	CC BY-NC	2123.088	Price et al., RECETOX, Masaryk University (CZ)	Methyl stearate
334.18509	CC BY-NC	1718.079	Price et al., RECETOX, Masaryk University (CZ)	6-Aminocaproic acid_3TMS
275.17328	CC BY-NC	1489.369	Price et al., RECETOX, Masaryk University (CZ)	6-Aminocaproic acid_2TMS
305.14038	CC BY-NC	1686.939	Price et al., RECETOX, Masaryk University (CZ)	Suberic acid_2TMS
234.10721	CC BY-NC	1564.514	Price et al., RECETOX, Masaryk University (CZ)	alpha-Methylcinammic acid_1TMS
250.96794	CC BY-NC	1308.31	Price et al., RECETOX, Masaryk University (CZ)	Maleic acid_2TMS
334.14865	CC BY-NC	1513.131	Price et al., RECETOX, Masaryk University (CZ)	Hydroxyproline_3TMS
498.91568	CC BY-NC	2272.319	Price et al., RECETOX, Masaryk University (CZ)	Cystine_4TMS
260.14963	CC BY-NC	1316.851	Price et al., RECETOX, Masaryk University (CZ)	Norleucine_2TMS
329.17691	CC BY-NC	1545.214	Price et al., RECETOX, Masaryk University (CZ)	Creatinine_3TMS
338.13629	CC BY-NC	2077.594	Price et al., RECETOX, Masaryk University (CZ)	Ferulic acid_2TMS
263.09412	CC BY-NC	1396.082	Price et al., RECETOX, Masaryk University (CZ)	Glutaric acid_2TMS
293.12958	CC BY-NC	1508.447	Price et al., RECETOX, Masaryk University (CZ)	Methionine_2TMS
340.14175	CC BY-NC	2274.972	Price et al., RECETOX, Masaryk University (CZ)	Cysteine_4TMS
335.18893	CC BY-NC	1542.761	Price et al., RECETOX, Masaryk University (CZ)	Cysteine_3TMS
305.15805	CC BY-NC	1420.506	Price et al., RECETOX, Masaryk University (CZ)	beta-Alanine_3TMS
263.10043	CC BY-NC	1674.306	Price et al., RECETOX, Masaryk University (CZ)	Acetylmethionine_1TMS
335.06458	CC BY-NC	1653.322	Price et al., RECETOX, Masaryk University (CZ)	Acetylmethionine_2TMS
434.26306	CC BY-NC	1908.314	Price et al., RECETOX, Masaryk University (CZ)	Lysine_4TMS
362.22369	CC BY-NC	1687.725	Price et al., RECETOX, Masaryk University (CZ)	Lysine_3TMS
381.16385	CC BY-NC	1764.405	Price et al., RECETOX, Masaryk University (CZ)	Methionine sulfoxide_3TMS
261.10855	CC BY-NC	1226.034	Price et al., RECETOX, Masaryk University (CZ)	Valine_2TMS
390.15857	CC BY-NC	1883.896	Price et al., RECETOX, Masaryk University (CZ)	Glucuro-3,6-lactone_3TMS isomer 1
388.14252	CC BY-NC	1922.836	Price et al., RECETOX, Masaryk University (CZ)	Glucuro-3,6-lactone_3TMS isomer 2
451.21841	CC BY-NC	2614.971	Price et al., RECETOX, Masaryk University (CZ)	Sucrose_8TMS
267.11365	CC BY-NC	1337.622	Price et al., RECETOX, Masaryk University (CZ)	Itaconic acid_2TMS
462.20978	CC BY-NC	1782.877	Price et al., RECETOX, Masaryk University (CZ)	Shikimic acid_4TMS
469.23215	CC BY-NC	1948.663	Price et al., RECETOX, Masaryk University (CZ)	Epinepherine_4TMS
305.16257	CC BY-NC	1883.718	Price et al., RECETOX, Masaryk University (CZ)	Tryptophol_2TMS
232.11545	CC BY-NC	1821.623	Price et al., RECETOX, Masaryk University (CZ)	Tryptophol_1TMS
383.16971	CC BY-NC	1925.553	Price et al., RECETOX, Masaryk University (CZ)	Tyrosine_3TMS
419.12936	CC BY-NC	2058.391	Price et al., RECETOX, Masaryk University (CZ)	3-Chlorotyrosine_3TMS
229.11282	CC BY-NC	1522.196	Price et al., RECETOX, Masaryk University (CZ)	Acetylproline_1TMS
312.1207	CC BY-NC	1746.645	Price et al., RECETOX, Masaryk University (CZ)	Vanillic acid_2TMS
335.17609	CC BY-NC	1438.379	Price et al., RECETOX, Masaryk University (CZ)	Homoserine_3TMS
404.14093	CC BY-NC	1658.598	Price et al., RECETOX, Masaryk University (CZ)	Homoserine_4TMS
384.16022	CC BY-NC	1813.416	Price et al., RECETOX, Masaryk University (CZ)	Homogentisic acid_3TMS
418.99484	CC BY-NC	2505.27	Price et al., RECETOX, Masaryk University (CZ)	Homocysteine_4TMS
351.15323	CC BY-NC	1645.979	Price et al., RECETOX, Masaryk University (CZ)	Homocysteine_3TMS
464.18985	CC BY-NC	1932.408	Price et al., RECETOX, Masaryk University (CZ)	Ascorbic acid_4TMS
498.86856	CC BY-NC	2728.015	Price et al., RECETOX, Masaryk University (CZ)	Spermine_6TMS
578.1349	CC BY-NC	2238.332	Price et al., RECETOX, Masaryk University (CZ)	Spermine_derivative
484.40952	CC BY-NC	3280.406	Price et al., RECETOX, Masaryk University (CZ)	Stigmasterol_1TMS
194.07974	CC BY-NC	1843.997	Price et al., RECETOX, Masaryk University (CZ)	Caffeine
509.22403	CC BY-NC	2077.476	Price et al., RECETOX, Masaryk University (CZ)	Myo-inositol_6TMS
176.09434	CC BY-NC	1704.209	Price et al., RECETOX, Masaryk University (CZ)	Cotinine
372.27695	CC BY-NC	2940.707	Price et al., RECETOX, Masaryk University (CZ)	Progesterone
266.10165	CC BY-NC	1791.219	Price et al., RECETOX, Masaryk University (CZ)	Acetylphenylalanine_1TMS
351.16812	CC BY-NC	1773.636	Price et al., RECETOX, Masaryk University (CZ)	Acetylalanine_2TMS
456.18604	CC BY-NC	2079.217	Price et al., RECETOX, Masaryk University (CZ)	Uric acid_4TMS
261.0784	CC BY-NC	1344.988	Price et al., RECETOX, Masaryk University (CZ)	Citraconic acid_2TMS
314.08749	CC BY-NC	1708.782	Price et al., RECETOX, Masaryk University (CZ)	Quinolinic aicd_2TMS
405.18152	CC BY-NC	1736.717	Price et al., RECETOX, Masaryk University (CZ)	Acetylglutamic acid_3TMS
320.11572	CC BY-NC	1759.747	Price et al., RECETOX, Masaryk University (CZ)	Acetylglutamic acid_2TMS
464.252	CC BY-NC	2446.155	Price et al., RECETOX, Masaryk University (CZ)	Serotonin_4TMS
390.19714	CC BY-NC	2474.028	Price et al., RECETOX, Masaryk University (CZ)	Serotonin_3TMS
368.15134	CC BY-NC	1998.854	Price et al., RECETOX, Masaryk University (CZ)	Xanthine_3TMS
308.13397	CC BY-NC	1353.518	Price et al., RECETOX, Masaryk University (CZ)	Serine_3TMS
380.17392	CC BY-NC	1559.921	Price et al., RECETOX, Masaryk University (CZ)	Serine_4TMS
462.21869	CC BY-NC	2362.292	Price et al., RECETOX, Masaryk University (CZ)	Acetyltryptophan_3TMS
390.17914	CC BY-NC	2417.979	Price et al., RECETOX, Masaryk University (CZ)	Acetyltryptophan_2TMS isomer 1
503.2298	CC BY-NC	2479.712	Price et al., RECETOX, Masaryk University (CZ)	Tryptophan_derivative
386.14746	CC BY-NC	2531.8	Price et al., RECETOX, Masaryk University (CZ)	Acetyltryptophan_2TMS isomer 2
304.17181	CC BY-NC	1950.659	Price et al., RECETOX, Masaryk University (CZ)	Tryptamine_2TMS
475.0034	CC BY-NC	2137.466	Price et al., RECETOX, Masaryk University (CZ)	Tryptamine_derivative
359.02829	CC BY-NC	2197.85	Price et al., RECETOX, Masaryk University (CZ)	Tryptamine_3TMS
374.20206	CC BY-NC	2210.789	Price et al., RECETOX, Masaryk University (CZ)	Tryptamine_3TMS
416.25623	CC BY-NC	2684.039	Price et al., RECETOX, Masaryk University (CZ)	Estradiol_2TMS
414.24042	CC BY-NC	2717.327	Price et al., RECETOX, Masaryk University (CZ)	Dehydroestradiol_2TMS
426.20065	CC BY-NC	2174.229	Price et al., RECETOX, Masaryk University (CZ)	Kynurenine_3TMS
484.6163	CC BY-NC	2127.988	Price et al., RECETOX, Masaryk University (CZ)	Kynurenine_4TMS
363.17108	CC BY-NC	1603.813	Price et al., RECETOX, Masaryk University (CZ)	Glutamic acid_3TMS spectra 1
328.2792	CC BY-NC	2031.754	Price et al., RECETOX, Masaryk University (CZ)	Palmitic acid_1TMS
350.14514	CC BY-NC	2149.28	Price et al., RECETOX, Masaryk University (CZ)	Kynurenine_2TMS
341.01743	CC BY-NC	2140.445	Price et al., RECETOX, Masaryk University (CZ)	1-Octadecanol_1TMS
440.22937	CC BY-NC	2063.897	Price et al., RECETOX, Masaryk University (CZ)	Dopamine_4TMS
369.12262	CC BY-NC	1803.491	Price et al., RECETOX, Masaryk University (CZ)	Dopamine_3TMS
371.22736	CC BY-NC	2690.648	Price et al., RECETOX, Masaryk University (CZ)	Estrone_1TMS
342.20087	CC BY-NC	2649.305	Price et al., RECETOX, Masaryk University (CZ)	Estrone_1TMS
407.17627	CC BY-NC	2196.115	Price et al., RECETOX, Masaryk University (CZ)	5-Hydroxyindole-3-acetic acid_3TMS
519.20136	CC BY-NC	2427.129	Price et al., RECETOX, Masaryk University (CZ)	Uridine_4TMS isomer 1
517.20398	CC BY-NC	2478.395	Price et al., RECETOX, Masaryk University (CZ)	Uridine_4TMS isomer 2
326.26367	CC BY-NC	2012.293	Price et al., RECETOX, Masaryk University (CZ)	Palmitoleic acid_1TMS
246.13393	CC BY-NC	1244.507	Price et al., RECETOX, Masaryk University (CZ)	Norvaline_2TMS
323.03726	CC BY-NC	1469.973	Price et al., RECETOX, Masaryk University (CZ)	Norvaline_3TMS
261.11807	CC BY-NC	1887.648	Price et al., RECETOX, Masaryk University (CZ)	Methyl-3-indolylacetate_1TMS
486.42563	CC BY-NC	3342.255	Price et al., RECETOX, Masaryk University (CZ)	beta-Sitosterol_1TMS
294.134	CC BY-NC	1622.569	Price et al., RECETOX, Masaryk University (CZ)	Phenylalanine_2TMS
460.95105	CC BY-NC	1907.744	Price et al., RECETOX, Masaryk University (CZ)	Homocitrulline_4TMS
278.10501	CC BY-NC	1497.347	Price et al., RECETOX, Masaryk University (CZ)	Acetylserine_2TMS
456.37824	CC BY-NC	3220.533	Price et al., RECETOX, Masaryk University (CZ)	7-Dehydrocholesterol_1TMS
271.08026	CC BY-NC	1506.984	Price et al., RECETOX, Masaryk University (CZ)	Salicylic acid_2TMS
557.59625	CC BY-NC	2684.795	Price et al., RECETOX, Masaryk University (CZ)	Cytidine_5TMS
359.2977	CC BY-NC	2235.718	Price et al., RECETOX, Masaryk University (CZ)	Stearic acid_1TMS
279.13321	CC BY-NC	1866.714	Price et al., RECETOX, Masaryk University (CZ)	Adenine_2TMS
466.22934	CC BY-NC	1884.504	Price et al., RECETOX, Masaryk University (CZ)	Galactose_5TMS isomer 1
351.17252	CC BY-NC	1925.431	Price et al., RECETOX, Masaryk University (CZ)	Adenine_3TMS
480.24384	CC BY-NC	1907.299	Price et al., RECETOX, Masaryk University (CZ)	Galactose_5TMS isomer 2
323.13168	CC BY-NC	1799.822	Price et al., RECETOX, Masaryk University (CZ)	Hippuric acid_2TMS
238.07059	CC BY-NC	1842.755	Price et al., RECETOX, Masaryk University (CZ)	Hippuric acid_1TMS
458.97305	CC BY-NC	1783.803	Price et al., RECETOX, Masaryk University (CZ)	2-Deoxyglucose_4TMS
359.11441	CC BY-NC	1734.565	Price et al., RECETOX, Masaryk University (CZ)	2,3-Dihydroxybenzoic acid_3TMS
468.37845	CC BY-NC	3053.203	Price et al., RECETOX, Masaryk University (CZ)	Ergocalciferol_TMS
270.25577	CC BY-NC	1925.397	Price et al., RECETOX, Masaryk University (CZ)	Methyl palmitate
259.07892	CC BY-NC	1551.845	Price et al., RECETOX, Masaryk University (CZ)	Maleamic acid_2TMS isomer 2
256.1189	CC BY-NC	1432.859	Price et al., RECETOX, Masaryk University (CZ)	Maleamic acid_2TMS isomer 1
331.14514	CC BY-NC	1526.203	Price et al., RECETOX, Masaryk University (CZ)	Maleamic acid_3TMS
466.22998	CC BY-NC	1890.842	Price et al., RECETOX, Masaryk University (CZ)	Glucose_5TMS isomer 1
448.21909	CC BY-NC	1911.034	Price et al., RECETOX, Masaryk University (CZ)	Glucose_5TMS isomer 2
349.15625	CC BY-NC	1510.38	Price et al., RECETOX, Masaryk University (CZ)	Aspartic acid_3TMS isomer
502.42047	CC BY-NC	3147.115	Price et al., RECETOX, Masaryk University (CZ)	alpha-Tocopherol_1TMS
502.332	CC BY-NC	2250.516	Price et al., RECETOX, Masaryk University (CZ)	Spermidine_5TMS
423.76837	CC BY-NC	2199.144	Price et al., RECETOX, Masaryk University (CZ)	Spermidine_4TMS
255.11404	CC BY-NC	1517.806	Price et al., RECETOX, Masaryk University (CZ)	Cytosine_2TMS
327.16107	CC BY-NC	1621.093	Price et al., RECETOX, Masaryk University (CZ)	Cytosine_3TMS
462.2586	CC BY-NC	1850.448	Price et al., RECETOX, Masaryk University (CZ)	Glycylvaline_4TMS
280.11725	CC BY-NC	1802.407	Price et al., RECETOX, Masaryk University (CZ)	Hypoxanthine_2TMS
417.30649	CC BY-NC	2851.973	Price et al., RECETOX, Masaryk University (CZ)	Pregnenolone_1TMS
471.2048	CC BY-NC	2088.587	Price et al., RECETOX, Masaryk University (CZ)	Levodopa_4TMS
224.08672	CC BY-NC	1457.841	Price et al., RECETOX, Masaryk University (CZ)	2-Methoxybenzoic acid_1TMS
531.23712	CC BY-NC	2673.374	Price et al., RECETOX, Masaryk University (CZ)	5-Methylcytidine_4TMS isomer 1
557.9187	CC BY-NC	2717.599	Price et al., RECETOX, Masaryk University (CZ)	5-Methylcytidine_4TMS isomer 2
306.09992	CC BY-NC	1644.168	Price et al., RECETOX, Masaryk University (CZ)	Acetylaspartic acid_2TMS
322.14883	CC BY-NC	1381.929	Price et al., RECETOX, Masaryk University (CZ)	Threonine_3TMS spectra 1
326.96603	CC BY-NC	1646.616	Price et al., RECETOX, Masaryk University (CZ)	2-Oxoadipic acid_2TMS isomer 2
328.98157	CC BY-NC	1621.799	Price et al., RECETOX, Masaryk University (CZ)	2-Oxoadipic acid_2TMS isomer 1
517.22162	CC BY-NC	2681.155	Price et al., RECETOX, Masaryk University (CZ)	Cytidine_4TMS
456.37826	CC BY-NC	3260.078	Price et al., RECETOX, Masaryk University (CZ)	Dehydrocholesterol_1TMS
466.36206	CC BY-NC	3289.183	Price et al., RECETOX, Masaryk University (CZ)	Dehydroergosterol_1TMS
454.36246	CC BY-NC	3242.543	Price et al., RECETOX, Masaryk University (CZ)	Cholestatrienol_1TMS
258.09448	CC BY-NC	1304.064	Price et al., RECETOX, Masaryk University (CZ)	Proline_2TMS