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1-[[Bis(methylthio)methylene]acetyl]-2-(4-(4-methoxyphenyl)-1,3-butadienyl)cyclopropane
SpectraBase Compound ID 9StNuSuzmJx
InChI InChI=1S/C19H22O2S2/c1-21-16-10-8-14(9-11-16)6-4-5-7-15-12-17(15)18(20)13-19(22-2)23-3/h4-11,13,15,17H,12H2,1-3H3/b6-4+,7-5+
InChIKey NQUXAQDRLVACPQ-YDFGWWAZSA-N
Mol Weight 346.5 g/mol
Molecular Formula C19H22O2S2
Exact Mass 346.106122 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 75F35ls7nlu
Name 1-[[Bis(methylthio)methylene]acetyl]-2-(4-(4-methoxyphenyl)-1,3-butadienyl)cyclopropane
CAS Registry Number 139378-14-6
Comments Less than 3 mono-isotopic peaks
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Formula C19H22O2S2
InChI InChI=1S/C19H22O2S2/c1-21-16-10-8-14(9-11-16)6-4-5-7-15-12-17(15)18(20)13-19(22-2)23-3/h4-11,13,15,17H,12H2,1-3H3/b6-4+,7-5+
InChIKey NQUXAQDRLVACPQ-YDFGWWAZSA-N
Molecular Weight 346.503 g/mol
SMILES C1(CC1\C=C\C=C\c1ccc(cc1)OC)C(C=C(SC)SC)=O
SPLASH splash10-001i-0009000000-1cbe4eda489483a40262
Source of Spectrum J-57-2261-10
Synonyms 1-{2-[(1E,3E)-4-(4-methoxyphenyl)-1,3-butadienyl]cyclopropyl}-3,3-bis(methylsulfanyl)-2-propen-1-one
Wiley ID 1339207