MSI_000015402

Reliable

排名分数: 5.01
参考来源: Vitis vinifera (PO:0009085: exocarp)

M/z: 424.9262
Mass Window: 424.9262 ~ 424.9263 (0.3 ppm)

参考注释

(3s,6e)-5-hydroxy-1-methyl-3-[(2s)-3,3,3-trichloro-2-methylpropyl]-6-[(2s)-3,3,3-trichloro-2-methylpropylidene]-3h-pyrazin-2-one_[M+H-H2O]+ (BioDeep_00002159338)
(3s,6e)-5-hydroxy-1-methyl-3-[(2s)-3,3,3-trichloro-2-methylpropyl]-6-[(2s)-3,3,3-trichloro-2-methylpropylidene]-3h-pyrazin-2-one

Formula: C13H16Cl6N2O2 (441.9342896)
SMILES: C[C@@H](/C=C1\C(O)=N[C@@H](C[C@H](C)C(Cl)(Cl)Cl)C(=O)N1C)C(Cl)(Cl)Cl