MSI_000015492

Reliable

排名分数: 4.71
参考来源: Vitis vinifera (PO:0009085: exocarp)

M/z: 461.0246
Mass Window: 461.0246 ~ 461.0247 (0.1 ppm)

参考注释

(2s)-2-(5-{[2,2'-bithiophen]-5-yl}thiophen-2-yl)-4-[5-(penta-1,3-diyn-1-yl)thiophen-2-yl]but-3-yn-1-ol_[M+H]+ (BioDeep_00002153432)
(2s)-2-(5-{[2,2'-bithiophen]-5-yl}thiophen-2-yl)-4-[5-(penta-1,3-diyn-1-yl)thiophen-2-yl]but-3-yn-1-ol

Formula: C25H16OS4 (460.00839659999997)
SMILES: CC#CC#Cc1ccc(C#C[C@@H](CO)c2ccc(-c3ccc(-c4cccs4)s3)s2)s1