MSI_000017497
Reliable
排名分数: 2.21
参考来源: Vitis vinifera (PO:0009087: mesocarp)
M/z: 658.0286
Mass Window: 658.0286 ~ 658.0287 (0.6 ppm)
参考注释
1-(2-{[6-(2,3,4,6,9,11-hexachloro-5-hydroxytridec-7-en-1-yl)-5-methyl-1,3-dioxan-4-yl](hydroxy)methyl}-1,3-thiazol-4-yl)ethanone_[M+H]+ (BioDeep_00002146361)1-(2-{[6-(2,3,4,6,9,11-hexachloro-5-hydroxytridec-7-en-1-yl)-5-methyl-1,3-dioxan-4-yl](hydroxy)methyl}-1,3-thiazol-4-yl)ethanone
Formula: C24H33Cl6NO5S (657.0210508)
SMILES:
CCC(Cl)CC(Cl)C=CC(Cl)C(O)C(Cl)C(Cl)C(Cl)CC1OCOC(C(O)c2nc(C(C)=O)cs2)C1C