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1-[[Bis(methylthio)methylene]acetyl]-2-(4-methoxystryl)cyclopropane
SpectraBase Compound ID FyCCit3zloS
InChI InChI=1S/C17H20O2S2/c1-19-14-8-5-12(6-9-14)4-7-13-10-15(13)16(18)11-17(20-2)21-3/h4-9,11,13,15H,10H2,1-3H3/b7-4+
InChIKey HANHAXAKNGHMMM-QPJJXVBHSA-N
Mol Weight 320.47 g/mol
Molecular Formula C17H20O2S2
Exact Mass 320.090472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ES17Xih46m8
Name 1-[[Bis(methylthio)methylene]acetyl]-2-(4-methoxystryl)cyclopropane
Alternate Name(s) 1-{2-[(E)-2-(4-methoxyphenyl)ethenyl]cyclopropyl}-3,3-bis(methylsulfanyl)-2-propen-1-one 7,7-Bis(methylthio)-6-methyl-1-(4-methoxyphenyl)-2,4,6-heptatriien-1-one
CAS Registry Number 139378-13-5
Comments Less than 3 mono-isotopic peaks
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Formula C17H20O2S2
InChI InChI=1S/C17H20O2S2/c1-19-14-8-5-12(6-9-14)4-7-13-10-15(13)16(18)11-17(20-2)21-3/h4-9,11,13,15H,10H2,1-3H3/b7-4+
InChIKey HANHAXAKNGHMMM-QPJJXVBHSA-N
Molecular Weight 320.465 g/mol
SMILES C1(C(\C=C\c2ccc(cc2)OC)C1)C(C=C(SC)SC)=O
SPLASH splash10-0a4i-0009000000-0f86f5b962035383d845
Source of Spectrum Y1-40-943-5
Wiley ID 1564879