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Propenone, 1-(4-chlorophenyl)-3-mercapto-3-methylthio-
SpectraBase Compound ID HwL1B11Q5FI
InChI InChI=1S/C10H9ClOS2/c1-14-10(13)6-9(12)7-2-4-8(11)5-3-7/h2-6,13H,1H3/b10-6+
InChIKey JJPJUVTVQDNAEQ-UXBLZVDNSA-N
Mol Weight 244.75 g/mol
Molecular Formula C10H9ClOS2
Exact Mass 243.978335 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kb5SRQJwBlu
Name Propenone, 1-(4-chlorophenyl)-3-mercapto-3-methylthio-
Alternate Name(s) (2E)-1-(4-Chlorophenyl)-3-(methylsulfanyl)-3-sulfanyl-2-propen-1-one (E)-1-(4-chlorophenyl)-3-mercapto-3-(methylthio)-2-propen-1-one (E)-1-(4-chlorophenyl)-3-mercapto-3-(methylthio)prop-2-en-1-one (E)-1-(4-chlorophenyl)-3-methylsulfanyl-3-sulfanyl-prop-2-en-1-one
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Formula C10H9ClOS2
InChI InChI=1S/C10H9ClOS2/c1-14-10(13)6-9(12)7-2-4-8(11)5-3-7/h2-6,13H,1H3/b10-6+
InChIKey JJPJUVTVQDNAEQ-UXBLZVDNSA-N
Molecular Weight 244.754 g/mol
SMILES S\C(=C/C(c1ccc(Cl)cc1)=O)SC
SPLASH splash10-000e-4920000000-69cf9f1528fc6a5f4f07
Source of Spectrum AD-0-2532-0
Wiley ID 1427413