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1-[[Bis(methylthio)methylene]acetyl]-2-(3,4-dimethoxystyryl)cyclopropane
SpectraBase Compound ID 4Xz62nDiJBP
InChI InChI=1S/C18H22O3S2/c1-20-16-8-6-12(9-17(16)21-2)5-7-13-10-14(13)15(19)11-18(22-3)23-4/h5-9,11,13-14H,10H2,1-4H3/b7-5+
InChIKey DJFDQQQCCQUVEP-FNORWQNLSA-N
Mol Weight 350.49 g/mol
Molecular Formula C18H22O3S2
Exact Mass 350.101037 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8gQFIhE4Xcn
Name 1-[[Bis(methylthio)methylene]acetyl]-2-(3,4-dimethoxystyryl)cyclopropane
Alternate Name(s) 1-{2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]cyclopropyl}-3,3-bis(methylsulfanyl)-2-propen-1-one
CAS Registry Number 139378-11-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O3S2
InChI InChI=1S/C18H22O3S2/c1-20-16-8-6-12(9-17(16)21-2)5-7-13-10-14(13)15(19)11-18(22-3)23-4/h5-9,11,13-14H,10H2,1-4H3/b7-5+
InChIKey DJFDQQQCCQUVEP-FNORWQNLSA-N
Molecular Weight 350.491 g/mol
SMILES C1(C(\C=C\c2cc(OC)c(cc2)OC)C1)C(C=C(SC)SC)=O
SPLASH splash10-0f79-0009000000-1fc4f4a819ce7a64c876
Source of Spectrum J-57-2261-10
Wiley ID 1341855