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2-(4-Cyanophenyl)-1-(methylthio)hex-1-ene
SpectraBase Compound ID 6lSjjCz7e6i
InChI InChI=1S/C14H17NS/c1-3-4-5-14(11-16-2)13-8-6-12(10-15)7-9-13/h6-9,11H,3-5H2,1-2H3/b14-11+
InChIKey FWYCEELYLDYZRF-SDNWHVSQSA-N
Mol Weight 231.36 g/mol
Molecular Formula C14H17NS
Exact Mass 231.108171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6JytOn0uf8Y
Name 2-(4-Cyanophenyl)-1-(methylthio)hex-1-ene
Alternate Name(s) 4-[(E)-1-butyl-2-(methylsulfanyl)ethenyl]benzonitrile
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Formula C14H17NS
InChI InChI=1S/C14H17NS/c1-3-4-5-14(11-16-2)13-8-6-12(10-15)7-9-13/h6-9,11H,3-5H2,1-2H3/b14-11+
InChIKey FWYCEELYLDYZRF-SDNWHVSQSA-N
Molecular Weight 231.357 g/mol
SMILES C(#N)c1ccc(\C(=C\SC)CCCC)cc1
SPLASH splash10-0023-0930000000-ba1645a8f992122df455
Source of Spectrum J-59-2822-4
Wiley ID 1232976