Results for untargeted MS search on m/z: (+/-) mode
| Details | Name | m/z | RT | RT_Units | Study | Ion_mode | MS_Instrument | Chromatography | Species | Source |
|---|---|---|---|---|---|---|---|---|---|---|
| AN001511 | Trigonelline_R2 | 18.0550 | 3.56 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 76.0764 | 4.43 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 78.9565 | 4.45 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 79.0220 | 1.34 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 91.0548 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 94.0657 | 3.41 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 94.0658 | 4.84 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 1,4-Dimethylimidazole | 97.0765 | 3.2 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 100.0398 | 3.93 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Valerolactam | 100.0762 | 4.59 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 101.0715 | 4.48 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 101.0795 | 4.6 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 102.0918 | 4.53 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Hexylamine | 102.1282 | 0.9 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 104.9927 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 105.0426 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | p-Xylene | 107.0859 | 0.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 108.0482 | 3.74 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | UNII:212JQJ15PS | 108.0942 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Methylimidazoleacetic acid_R1 | 109.0400 | 3.65 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Cytosine_R1 | 112.0509 | 2.14 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Cytosine_R2 | 112.0509 | 2.62 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | (S)-1-Pyrroline-5-carboxylate | 114.0553 | 1.85 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Creatinine | 114.0666 | 2.78 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Caprolactam | 114.0917 | 4.72 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | L-Prolinamide | 115.0870 | 4.74 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | n-Hexanamide | 116.1073 | 4.34 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | n-Hexanamide_R2 | 116.1073 | 4.56 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | n-Hexanamide_R1 | 116.1073 | 4.68 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Indole;1-Benzazole | 118.0653 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Betaine | 118.0865 | 3.91 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Benzimidazole | 119.0606 | 3.41 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 120.1022 | 4.55 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 120.1022 | 4.68 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 120.1022 | 4.83 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 120.9665 | 4.43 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 121.0399 | 1.6 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Acetophenone_R1 | 121.0650 | 1.24 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Acetophenone_R2 | 121.0651 | 1.16 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 121.0889 | 4.54 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 1_2_4-Trimethylbenzene | 121.1013 | 0.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Nicotinamide | 123.0555 | 1.22 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 124.0428 | 2.12 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Taurine | 126.0221 | 2.84 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 5-Methylcytosine | 126.0663 | 3.12 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Imidazoleacetic acid | 127.0503 | 3.65 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 127.0981 | 4.97 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 128.9535 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Dihydrothymine | 129.0659 | 3.92 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 1-Pyrroline-4-hydroxy-2-carboxylate | 130.0500 | 3.99 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 4-Guanidinobutanal | 130.0977 | 5.1 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | N,N-Diisopropylethylamine (DIPEA) | 130.1591 | 3.2 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 131.0855 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | N-Acetylputrescine | 131.1179 | 4.65 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 3-Guanidinopropanoate | 132.0768 | 3.89 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Leucine_R1 | 132.1019 | 3.81 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Leucine_R2 | 132.1020 | 4.33 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | N-Carbamoylputrescine | 132.1133 | 4.74 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | S_S-Dimethyl-beta-propiothetin | 135.0475 | 4.26 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | p-cymene | 135.1168 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Hypoxanthine_R2 | 137.0457 | 1.63 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Hypoxanthine_R1 | 137.0457 | 1.72 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 3-Carboxy-1-methylpyridinium;N-Methylnicotinicacid | 138.0548 | 3.81 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Tyramine | 138.0913 | 1.28 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 4-Nitroaniline | 139.0501 | 1.59 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Methylimidazoleaceticacid_R3 | 141.0658 | 3.51 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Methylimidazoleaceticacid_R2 | 141.0658 | 3.75 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 141.1386 | 4.43 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 141.1387 | 5.36 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Guvacoline | 142.0864 | 4.03 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Ectoine | 143.0814 | 4 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | DL-Stachydrine_R1 | 144.1017 | 3.83 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | DL-Stachydrine_R2 | 144.1017 | 4.3 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Valpromide_R3 | 144.1384 | 4.45 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Valpromide_R2 | 144.1384 | 4.82 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Valpromide_R1 | 144.1385 | 5.45 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 144.9275 | 4.44 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 144.9848 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Acetylcholine_R1 | 145.1102 | 4.54 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | N-(5-Aminopentyl)acetamide_R2 | 145.1336 | 4.11 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | N-(5-Aminopentyl)acetamide_R1 | 145.1336 | 4.57 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 146.0188 | 4.36 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Tetrahydro-2-thiophenylacetic acid | 147.0474 | 4.1 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 147.1167 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | afegostat | 148.0967 | 3.7 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | n-Amylbenzene | 149.1324 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 1-Methyladenine | 150.0774 | 3.6 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 6-Methyl[1,2,4]triazolo[4,3-b]pyridazin-8-ol | 151.0615 | 1.53 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | (R)-1-Aminopropan-2-ol | 151.1441 | 4.43 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 151.1442 | 4.43 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Guanine | 152.0567 | 1.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Paracetamol_R1 | 152.0706 | 3.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Paracetamol_R2 | 152.0706 | 4.34 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 154.0530 | 1.7 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 4-Amino-N'-hydroxypyrimidine-5-carboximidamide | 154.0723 | 2.31 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 155.0815 | 3.63 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 155.0815 | 3.77 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 155.0815 | 4.29 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 156.0325 | 2.5 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 156.0402 | 0.96 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Arecoline | 156.1021 | 4.18 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 157.0971 | 4.09 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 157.0972 | 3.9 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 3-Methylcrotonylglycine | 158.0812 | 3.52 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | tranexamic acid_R1 | 158.1175 | 3.81 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | tranexamic acid_R3 | 158.1176 | 3.71 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | tranexamic acid_R2 | 158.1176 | 4.45 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 2,2,6,6-Tetramethyl-4-piperidinol | 158.1540 | 3.65 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 4-Methylene-L-glutamine | 159.0763 | 3.9 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 4-Methylene-L-glutamate | 160.0604 | 1.26 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 3-Dehydrocarnitine_R1 | 160.0967 | 3.77 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 3-Dehydrocarnitine_R3 | 160.0968 | 4.07 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 3-Dehydrocarnitine_R4 | 160.0969 | 3.56 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 3-Dehydrocarnitine_R2 | 160.0969 | 3.67 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | delta-Guanidinovalericacid | 160.1080 | 4.1 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Pregabalin_R1 | 160.1330 | 3.66 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Acetyl-beta-methylcholine | 160.1332 | 4.62 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 160.9015 | 4.46 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 2_2'-Iminodipropanoate | 162.0761 | 3.58 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | DL-Carnitine_R1 | 162.1123 | 3.69 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | DL-Carnitine_R3 | 162.1123 | 3.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | (S)-Carnitine | 162.1123 | 4.13 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | DL-Carnitine_R2 | 162.1123 | 4.16 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | L(-)-Carnitine | 162.1123 | 4.26 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 162.1490 | 4.82 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 162.4897 | 5.43 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 1,3-Diisopropylbenzene | 163.1480 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 164.0436 | 3.42 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | N(6),N(6)-Dimethyladenine | 164.0931 | 4.05 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 164.1283 | 4.58 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 7-Methylguanine | 166.0724 | 2.44 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | D-Phenylalanine | 166.0863 | 4.55 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 167.0484 | 3.42 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 168.0689 | 3.25 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 168.0689 | 3.57 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 168.9460 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 169.9858 | 2.86 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 170.0480 | 1.77 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 170.0482 | 2.5 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 4-Hydroxy-5-[(E)-(hydroxymethylene)amino]-6-iminio-2-imino-1,2,5,6-tetrahydropyrimidin-5-ide | 170.0672 | 1.12 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Aceclidine | 170.1176 | 4.33 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | (-)-Lupinine | 170.1538 | 0.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 171.0798 | 1.7 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Gabapentin_R2 | 172.1332 | 4.5 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Gabapentin_R1 | 172.1333 | 4.59 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 172.9798 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Glycylproline | 173.0922 | 3.95 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | N-(4-Carbamimidamidobutyl)acetamide | 173.1398 | 4.49 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Sulfanilic acid | 174.0219 | 1.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Hexanoylglycine_R1 | 174.1125 | 4.06 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Hexanoylglycine_R2 | 174.1126 | 4.23 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | L-Indospicine | 174.1238 | 4.13 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Imagabalin | 174.1488 | 3.53 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | formyl-isoglutamine | 175.0713 | 3.81 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | ionene | 175.1480 | 0.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 176.0352 | 1.69 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | (2S)-2-Amino-8-hydroxyoctanoic acid_R1 | 176.1281 | 3.93 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | (2S)-2-Amino-8-hydroxyoctanoic acid_R3 | 176.1281 | 4.15 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | (2S)-2-Amino-8-hydroxyoctanoic acid_R4 | 176.1281 | 4.34 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | (2S)-2-Amino-8-hydroxyoctanoic acid_R2 | 176.1281 | 4.45 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 2-Amino-4-[(3-aminopropyl)amino]butanoic acid | 176.1392 | 3.91 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 178.0630 | 3.73 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 179.0047 | 3.9 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 180.0600 | 3.74 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 7-Aminomethyl-7-deazaguanine | 180.0879 | 1.85 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Phenacetin_R1 | 180.1018 | 4.53 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Phenacetin_R2 | 180.1019 | 3.57 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | (5E,7E)-Dodecadienal | 181.1586 | 0.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 2-Amino-7-methyl-7,9-dihydro-1H-purine-6,8-dione | 182.0674 | 1.97 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 182.0846 | 3.2 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Anhydroecgonine methyl ester | 182.1175 | 4.36 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 184.0460 | 1.71 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Cholinesulfate_R1 | 184.0638 | 2.35 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Cholinesulfate_R2 | 184.0639 | 1.94 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 184.0915 | 4.27 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | methyprylon_R1 | 184.1333 | 4.55 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | methyprylon_R2 | 184.1334 | 4.17 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | methyprylon_R3 | 184.1334 | 4.41 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 184.9201 | 4.44 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | UNII:V18J24E25E | 185.1286 | 4.55 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 186.9953 | 4.36 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | L-Alanyl-L-proline | 187.1078 | 4.16 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | N-Methylpyridinium | 187.1229 | 3.41 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 8-Amino-7-oxononanoate_R3 | 188.1282 | 3.73 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 8-Amino-7-oxononanoate_R1 | 188.1282 | 3.95 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 8-Amino-7-oxononanoate_R2 | 188.1282 | 4.14 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 8-Amino-7-oxononanoate_R4 | 188.1282 | 4.45 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 188.1395 | 4.65 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 6-Acetamido-3-aminohexanoate | 189.1233 | 4 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 2-oxo-1_2-dihydroquinoline-4-carboxylate | 190.0468 | 0.95 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Kynurenic acid | 190.0498 | 1.44 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Prenyl-L-cysteine | 190.0898 | 3.92 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | (2S)-2-{[1-(R)-Carboxyethyl]amino}pentanoate_R1 | 190.1072 | 3.94 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | (2S)-2-{[1-(R)-Carboxyethyl]amino}pentanoate_R2 | 190.1074 | 4.08 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 190.1438 | 4.22 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 2-Amino-4-[(4-aminobutyl)amino]butanoic acid | 190.1550 | 3.81 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Heptanophenone | 191.1428 | 0.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 192.0090 | 1.71 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 2-Amino-4-hydroxypteridine-6-carbaldehyde | 192.0516 | 1.34 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | trihomomethionine | 192.1053 | 3.52 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 192.1230 | 4.15 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | DEET | 192.1381 | 0.89 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 1-(4-Methoxyphenyl)piperazine | 193.1337 | 3.61 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | beta-Ionone | 193.1587 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 1,6-Dimethylpyrimido[5,4-e][1,2,4]triazine-5,7(1H,6H)-dione | 194.0673 | 1.52 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 4-Aminohippuricacid | 195.0765 | 4.2 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 195.1228 | 1.22 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 196.0041 | 1.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 196.0638 | 2.77 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 4-(Nitrosoamino)-1-(3-pyridinyl)-1-butanol | 196.1080 | 3.41 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 198.0620 | 0.94 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Mercaptoethanol | 198.0622 | 1.34 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 198.0795 | 3.06 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 198.0796 | 1.94 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 4,4-Dimethyl-5-(methylcarbamoyloxyimino)valeronitrile | 198.1237 | 4.33 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 198.1487 | 0.89 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 198.1488 | 1.86 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 198.1851 | 0.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 2_4-Dinitrophenylhydrazine | 199.0460 | 0.96 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 200.1644 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 200.1644 | 1 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 201.0217 | 1.26 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 201.0657 | 0.94 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 201.0693 | 4.1 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 201.1346 | 3.99 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 201.1477 | 3.83 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 3-[(1R,2S,5R,6S)-5-Hydroxy-7-oxabicyclo[4.1.0]hept-2-yl]-L-alanine | 202.1075 | 4.09 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 202.1551 | 4.59 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 202.1552 | 4.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 202.9694 | 4.43 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Proclavaminicacid | 203.1025 | 3.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 204.1058 | 4.14 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Acetyl-L-carnitine_R1 | 204.1230 | 4.13 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Acetyl-L-carnitine_R2 | 204.1231 | 4.01 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 205.8919 | 4.44 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Xanthurenic acid_R4 | 206.0446 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Xanthurenic acid_R2 | 206.0446 | 0.95 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Xanthurenic acid_R3 | 206.0447 | 1.04 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Xanthurenic acid_R1 | 206.0447 | 1.79 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 206.0775 | 3.31 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | tetrahomomethionine | 206.1210 | 4.31 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 206.1500 | 3.7 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 208.0241 | 1.04 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 208.0274 | 1.17 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 208.1003 | 4.13 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | MDMA Methylene homolog | 208.1332 | 3.47 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 208.9386 | 4.42 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 4-(Heptyloxy)phenol | 209.1534 | 0.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 209.1772 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | dl-Bamethane | 210.1490 | 4.12 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 210.9566 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | UNII:BI845A018T | 211.1691 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 2-Amino-4-oxo-1,4,5,6,7,8-hexahydro-6-pteridinecarboxylic acid | 212.0778 | 1.24 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Zalcitabine | 212.1030 | 3.6 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 212.1062 | 1.69 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | UNII:6S7S02945H | 212.2007 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 212.9722 | 4.4 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 214.1801 | 1 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 215.0810 | 3.54 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Ethyl N-acetyl-N-butyl-beta-alaninate_R1 | 216.1593 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Ethyl N-acetyl-N-butyl-beta-alaninate_R2 | 216.1596 | 1.85 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | N,N-Diethyl-4-methyl-1-piperazinecarboxamide 4-oxide_R2 | 216.1707 | 3.81 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | N,N-Diethyl-4-methyl-1-piperazinecarboxamide 4-oxide_R1 | 216.1709 | 4.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | gamma-Glutamyl-gamma-aminobutyraldehyde | 217.1185 | 4.03 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | N-alpha-Acetylarginine | 217.1296 | 3.91 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | N-alpha-L-Acetyl-arginine | 217.1297 | 4.04 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | tyramine sulfate_R3 | 218.0481 | 1.08 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | tyramine sulfate_R2 | 218.0481 | 1.17 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | tyramine sulfate_R1 | 218.0481 | 1.25 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Propionylcarnitine | 218.1387 | 4.04 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | gamma-L-Glutamylputrescine_R1 | 218.1500 | 3.77 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | gamma-L-Glutamylputrescine_R2 | 218.1500 | 4.14 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | deoxyhypusine | 218.1864 | 3.65 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Pantothenicacid(VitaminB5)_R2 | 220.1180 | 3.94 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Pantothenicacid(VitaminB5)_R1 | 220.1180 | 4.09 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 220.1656 | 3.69 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 220.1656 | 3.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 6-Acetyl-2-amino-1,7,8,9-tetrahydro-4H-pyrimido[4,5-b][1,4]diazepin-4-one | 222.0986 | 1.64 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 224.0952 | 3.58 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 225.0539 | 1.16 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 225.9805 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 226.0822 | 2.13 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Aciclovir | 226.0933 | 1.68 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 226.1799 | 0.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 226.1800 | 1.56 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | trans-Methyl dihydrojasmonate | 227.1639 | 0.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Cyprodenate_R1 | 228.1956 | 0.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Cyprodenate_R2 | 228.1956 | 1 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Deoxyuridine | 229.0820 | 3.48 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Prolylleucine | 229.1549 | 4.18 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 230.1864 | 4.04 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 230.2479 | 3.36 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 230.9764 | 2.77 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Asulam | 231.0433 | 0.92 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Valyl-4-hydroxyproline | 231.1340 | 3.31 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Butyryl-L-carnitine | 232.1544 | 3.96 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | g-Aminobutyryl-lysine | 232.1657 | 4.09 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | mebutamate | 233.1497 | 2.36 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 234.0399 | 2.65 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Hypusine | 234.1813 | 3.93 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 234.9178 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 234.9179 | 4.35 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 7-Methoxy-2-methylene-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-5-carboxylic acid | 236.0552 | 0.94 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Biopterin | 238.0938 | 2.19 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Xanthopterin-B2 | 239.0775 | 1.12 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | PEG n5_R1 | 239.1489 | 1.29 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 241.1217 | 1.7 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | UNII:OG645J8RVW | 241.1547 | 4.25 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 242.0481 | 1.26 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 242.1170 | 2.36 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | (3R,6R)-6-Hydroxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl 3-methylbutanoate | 242.1749 | 0.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 242.2113 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 242.9620 | 4.43 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 244.0240 | 3.5 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | N-Undecanoylglycine_R2 | 244.1905 | 0.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | N-Undecanoylglycine_R1 | 244.1908 | 1.55 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Asparaginyl-4-hydroxyproline | 245.1085 | 3.48 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 246.0796 | 1.04 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 3-[(2-Methylbutanoyl)oxy]-4-(trimethylammonio)butanoate | 246.1700 | 3.89 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 247.0040 | 4.3 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 247.1765 | 4 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | lys-thr | 248.1605 | 3.94 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 249.1809 | 3.79 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 250.9491 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 252.9284 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 253.0945 | 3.41 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 254.2112 | 0.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 254.9828 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 255.1346 | 3.35 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | PEG n5_R2 | 256.1755 | 1.3 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 256.2269 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 1-(beta-D-Ribofuranosyl)-1_4-dihydronicotinamide | 257.1134 | 2.03 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Benserazide | 258.1086 | 2.15 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | (5R,6S)-3-[(2-Aminoethyl)sulfanyl]-6-(hydroxymethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid | 259.0748 | 1.12 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 259.2792 | 3.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | (4R)-4-{[3-(2-Aminoethyl)-1H-indol-5-yl]methyl}-1,3-oxazolidin-2-one | 260.1397 | 2.22 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | gamma-Glutamylleucine | 261.1446 | 4.33 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | carisoprodol | 261.1810 | 3.8 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 262.8880 | 3.59 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 264.1778 | 4.01 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 266.1389 | 3.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 266.9232 | 4.43 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 267.2066 | 3.42 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 268.9984 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 268.9985 | 4.31 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | N-Tridecanoylglycine | 272.2218 | 0.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 274.9102 | 4.36 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | gln-lys | 275.1713 | 3.33 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | tybamate | 275.1966 | 3.82 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 277.1547 | 2.83 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 277.1758 | 3.77 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 278.9440 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 281.1495 | 3.81 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 8-Oxocoformycin | 283.1038 | 1.55 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | PEG n6_R1 | 283.1752 | 1.42 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 284.9725 | 4.43 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Psilocybin | 285.0982 | 1.16 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 287.1636 | 2.35 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 289.0853 | 1.45 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 289.0854 | 1.55 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | N-(1-{[Methyl(2-methyl-2-propanyl)carbamoyl]amino}ethyl)-alpha-asparagine | 289.1870 | 3.31 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 290.0916 | 1.71 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 290.8844 | 4.44 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 291.2528 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 292.9597 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 294.9390 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 296.9184 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 2-Methylguanosine | 298.1147 | 1.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | PEG n6_R2 | 300.2017 | 1.34 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | PEG n6_R3 | 300.2017 | 1.43 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 301.2121 | 3.82 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 305.3032 | 3.34 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 306.1813 | 1.93 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 307.0989 | 1.66 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 1-Hexadecanoylpyrrolidine | 310.3102 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | PEG n7 | 314.2173 | 1.19 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 316.9210 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 318.9003 | 4.3 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Linoleoyl Ethanolamide | 324.2895 | 0.89 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | Oleoylethanolamide | 326.3052 | 0.89 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 327.0680 | 1.8 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 329.0072 | 4.32 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 329.0811 | 1.71 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 332.3312 | 3.31 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 332.8951 | 4.43 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 332.9522 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 335.2790 | 0.89 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 338.0501 | 0.93 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Erucamide | 338.3413 | 0.87 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 340.8822 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 343.2957 | 3.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 344.2279 | 1.55 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 351.0016 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 352.3209 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 354.3365 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 356.9134 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 358.2435 | 1.26 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 4-[(E)-2-{[1-Carboxy-3-(methylsulfinyl)propyl]amino}vinyl]-2,3-dihydro-2,6-pyridinedicarboxylic acid | 359.0906 | 1.76 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 364.2345 | 1.96 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 366.0822 | 2.27 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 366.0824 | 1.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 368.0974 | 0.94 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 4-Hydroxy-8-(beta-D-talopyranosyloxy)-2-quinolinecarboxylic acid_R2 | 368.0978 | 1.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 4-Hydroxy-8-(beta-D-talopyranosyloxy)-2-quinolinecarboxylic acid_R1 | 368.0978 | 2.86 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 368.3158 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 370.3314 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | Deoxyribosetriphosphate | 374.9629 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 375.1444 | 1.68 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 376.9421 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | RiboflavinB2 | 377.1455 | 1.66 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 378.9214 | 4.39 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 380.8746 | 4.36 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 380.9007 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 382.0772 | 1.69 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 384.3106 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | PEG n8 | 388.2542 | 1.67 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 396.3319 | 0.89 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | (S-(R*,R*))-3-((1-Carboxy-3-phenylpropyl)amino)-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-acetic Acid | 397.1759 | 1.07 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 400.9033 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 402.2700 | 1.36 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 402.8827 | 4.36 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 414.9554 | 4.36 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 424.8644 | 4.35 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | PEG n9 | 432.2809 | 1.82 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 433.0048 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 438.9167 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 440.3582 | 0.89 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 440.3585 | 1.01 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 444.0566 | 0.92 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 444.3798 | 0.88 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 446.2963 | 1.42 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 446.8467 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 455.2291 | 1.05 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 456.9659 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 458.9454 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 460.9244 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 461.8965 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 462.8780 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 464.8833 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 465.9264 | 3.5 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | PEG n10 | 476.3070 | 1.94 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
| AN001511 | 477.1721 | 1.71 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 480.9274 | 4.36 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 482.1276 | 1.71 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 484.3846 | 0.9 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 484.8860 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 486.8653 | 4.35 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 490.3225 | 1.56 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 496.9583 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 497.0598 | 0.92 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 504.8886 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 508.8471 | 4.36 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 515.0081 | 24.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 520.9199 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 528.8498 | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |||
| AN001511 | 534.3490 | 1.67 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 538.9693 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 549.6216 | 3.01 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 550.6286 | 0.91 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 562.9304 | 4.38 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 569.8402 | 4.37 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 572.1735 | 1.27 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 709.0729 | 0.92 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 713.0667 | 0.9 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 715.0634 | 0.92 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine | |
| AN001511 | 717.0609 | 0.92 | Minutes | ST000922 | POSITIVE | Thermo Q Exactive HF hybrid Orbitrap | HILIC | Crab | Urine |
