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2-(4-chlorophenyl)sulfanyl-5-methyl-4-methylene-hex-5-enenitrile
SpectraBase Compound ID Em9UTB6vNDO
InChI InChI=1S/C14H14ClNS/c1-10(2)11(3)8-14(9-16)17-13-6-4-12(15)5-7-13/h4-7,14H,1,3,8H2,2H3
InChIKey KTQKAQDCMQVCQT-UHFFFAOYSA-N
Mol Weight 263.79 g/mol
Molecular Formula C14H14ClNS
Exact Mass 263.053548 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D1KhtlgiNVw
Name 2-(4-chlorophenyl)sulfanyl-5-methyl-4-methylene-hex-5-enenitrile
Comments Less than 3 mono-isotopic peaks
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Formula C14H14ClNS
InChI InChI=1S/C14H14ClNS/c1-10(2)11(3)8-14(9-16)17-13-6-4-12(15)5-7-13/h4-7,14H,1,3,8H2,2H3
InChIKey KTQKAQDCMQVCQT-UHFFFAOYSA-N
Molecular Weight 263.786 g/mol
SMILES C(C(=C)C)(CC(C#N)Sc1ccc(cc1)Cl)=C
SPLASH splash10-0006-9050000000-7969dd8698f908ac84c5
Source of Spectrum KC-0-842-2
Synonyms 2-(4-chlorophenyl)sulfanyl-5-methyl-4-methylidene-hex-5-enenitrile 2-[(4-chlorophenyl)thio]-5-methyl-4-methylene-5-hexenenitrile 2-[(4-chlorophenyl)thio]-5-methyl-4-methylene-hex-5-enenitrile
Wiley ID 787768