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1-[2-[Bis(methylthio)methylene]propanoyl]-2-styrylcyclopropane
SpectraBase Compound ID 6bLRL6IpXxD
InChI InChI=1S/C17H20OS2/c1-12(17(19-2)20-3)16(18)15-11-14(15)10-9-13-7-5-4-6-8-13/h4-10,14-15H,11H2,1-3H3/b10-9+
InChIKey HUOXSBBMDOLNDO-MDZDMXLPSA-N
Mol Weight 304.47 g/mol
Molecular Formula C17H20OS2
Exact Mass 304.095558 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lvmgqx0mrFi
Name 1-[2-[Bis(methylthio)methylene]propanoyl]-2-styrylcyclopropane
Alternate Name(s) 2-methyl-3,3-bis(methylsulfanyl)-1-{2-[(E)-2-phenylethenyl]cyclopropyl}-2-propen-1-one
CAS Registry Number 139378-09-9
Comments Less than 3 mono-isotopic peaks
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Formula C17H20OS2
InChI InChI=1S/C17H20OS2/c1-12(17(19-2)20-3)16(18)15-11-14(15)10-9-13-7-5-4-6-8-13/h4-10,14-15H,11H2,1-3H3/b10-9+
InChIKey HUOXSBBMDOLNDO-MDZDMXLPSA-N
Molecular Weight 304.466 g/mol
SMILES C1(C(C(=C(SC)SC)C)=O)C(\C=C\c2ccccc2)C1
SPLASH splash10-000i-0090000000-b1299a8dcf66b02a0bf1
Source of Spectrum J-57-2261-10
Wiley ID 1306428