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4-[[(Z)-2-(3-chlorophenyl)-3-methoxy-prop-1-enyl]sulfanylmethyl]benzenecarbonitrile
SpectraBase Compound ID 9piUHYkYJ5U
InChI InChI=1S/C18H16ClNOS/c1-21-11-17(16-3-2-4-18(19)9-16)13-22-12-15-7-5-14(10-20)6-8-15/h2-9,13H,11-12H2,1H3/b17-13+
InChIKey RICZYXAUCHRECP-GHRIWEEISA-N
Mol Weight 329.85 g/mol
Molecular Formula C18H16ClNOS
Exact Mass 329.064113 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6x2aN1K9Dmm
Name 4-[[(Z)-2-(3-chlorophenyl)-3-methoxy-prop-1-enyl]sulfanylmethyl]benzenecarbonitrile
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Formula C18H16ClNOS
InChI InChI=1S/C18H16ClNOS/c1-21-11-17(16-3-2-4-18(19)9-16)13-22-12-15-7-5-14(10-20)6-8-15/h2-9,13H,11-12H2,1H3/b17-13+
InChIKey RICZYXAUCHRECP-GHRIWEEISA-N
Molecular Weight 329.845 g/mol
SMILES c1(\C(=C\SCc2ccc(C#N)cc2)COC)cc(Cl)ccc1
SPLASH splash10-004i-0902000000-f8b397626c0a384167de
Source of Spectrum J-63-542-8
Synonyms 4-[[(Z)-2-(3-chlorophenyl)-3-methoxy-prop-1-enyl]sulfanylmethyl]benzonitrile 4-[[[(Z)-2-(3-chlorophenyl)-3-methoxy-prop-1-enyl]thio]methyl]benzonitrile 4-[[[(Z)-2-(3-chlorophenyl)-3-methoxyprop-1-enyl]thio]methyl]benzonitrile
Wiley ID 1327072