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7,7-Bis(methylthio)-1-(2-furyl)-2,4,6-heptatriien-1-one
SpectraBase Compound ID Jem5WSP5cF9
InChI InChI=1S/C13H14O2S2/c1-16-13(17-2)9-5-3-4-7-11(14)12-8-6-10-15-12/h3-10H,1-2H3/b5-3+,7-4+
InChIKey HDWVTLLOJBKGBL-HJIKTHEYSA-N
Mol Weight 266.37 g/mol
Molecular Formula C13H14O2S2
Exact Mass 266.043522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 58jL4skuPOw
Name 7,7-Bis(methylthio)-1-(2-furyl)-2,4,6-heptatriien-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C13H14O2S2
InChI InChI=1S/C13H14O2S2/c1-16-13(17-2)9-5-3-4-7-11(14)12-8-6-10-15-12/h3-10H,1-2H3/b5-3+,7-4+
InChIKey HDWVTLLOJBKGBL-HJIKTHEYSA-N
Molecular Weight 266.373 g/mol
SMILES c1(C(\C=C\C=C\C=C(SC)SC)=O)occc1
SPLASH splash10-0uxr-0090000000-7def505a50ada9fb502e
Source of Spectrum Y1-40-943-5
Wiley ID 1564876