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7,7-Bis(methylthio)-6-methyl-1-(2-thienyl)-2,4,6-heptatriien-1-one
SpectraBase Compound ID GDeUkOHNZSG
InChI InChI=1S/C14H16OS3/c1-11(14(16-2)17-3)7-4-5-8-12(15)13-9-6-10-18-13/h4-10H,1-3H3/b7-4+,8-5+
InChIKey DWXDYOZVANIQDY-NSLJXJERSA-N
Mol Weight 296.46 g/mol
Molecular Formula C14H16OS3
Exact Mass 296.036329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9sAWtErtVMs
Name 7,7-Bis(methylthio)-6-methyl-1-(2-thienyl)-2,4,6-heptatriien-1-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16OS3
InChI InChI=1S/C14H16OS3/c1-11(14(16-2)17-3)7-4-5-8-12(15)13-9-6-10-18-13/h4-10H,1-3H3/b7-4+,8-5+
InChIKey DWXDYOZVANIQDY-NSLJXJERSA-N
Molecular Weight 296.461 g/mol
SMILES C(=C(\C=C\C=C\C(c1sccc1)=O)C)(SC)SC
SPLASH splash10-001i-0090000000-df8d1acbd9131ca69a65
Source of Spectrum Y1-40-943-5
Wiley ID 1564877