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2-Benzoyl-3,3-bis(ethylthio)-2-propenal
SpectraBase Compound ID GOq7ThC0IkX
InChI InChI=1S/C14H16O2S2/c1-3-17-14(18-4-2)12(10-15)13(16)11-8-6-5-7-9-11/h5-10H,3-4H2,1-2H3
InChIKey AVNJJOMIXXLIEK-UHFFFAOYSA-N
Mol Weight 280.4 g/mol
Molecular Formula C14H16O2S2
Exact Mass 280.059172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 85P02Z78ImV
Name 2-Benzoyl-3,3-bis(ethylthio)-2-propenal
Alternate Name(s) 2-benzoyl-3,3-bis(ethylsulfanyl)acrylaldehyde
CAS Registry Number 134129-39-8
Comments Less than 3 mono-isotopic peaks
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Formula C14H16O2S2
InChI InChI=1S/C14H16O2S2/c1-3-17-14(18-4-2)12(10-15)13(16)11-8-6-5-7-9-11/h5-10H,3-4H2,1-2H3
InChIKey AVNJJOMIXXLIEK-UHFFFAOYSA-N
Molecular Weight 280.400 g/mol
SMILES C(C(=O)c1ccccc1)(=C(SCC)SCC)C=O
SPLASH splash10-0a4i-0930000000-3a0eea2d7b141dedff18
Source of Spectrum U-1992-389-3
Wiley ID 764220