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1-Chloro-1-cyano-2-[(2'-methyl-1'-phenyl)prop-1'-enyl]cyclohex-3-ene

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-Chloro-1-cyano-2-[(2'-methyl-1'-phenyl)prop-1'-enyl]cyclohex-3-ene
SpectraBase Compound ID JeGs1AUP7iu
InChI InChI=1S/C17H18ClN/c1-13(2)16(14-8-4-3-5-9-14)15-10-6-7-11-17(15,18)12-19/h3-6,8-10,15H,7,11H2,1-2H3/t15?,17-/m1/s1
InChIKey ABBNNCRIRQIRMW-OMOCHNIRSA-N
Mol Weight 271.79 g/mol
Molecular Formula C17H18ClN
Exact Mass 271.112777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BSvVEziPM9H
Name (S)-1-Chloro-1-cyano-2-[(2'-methyl-1'-phenyl)prop-1'-enyl]cyclohex-3-ene
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18ClN
InChI InChI=1S/C17H18ClN/c1-13(2)16(14-8-4-3-5-9-14)15-10-6-7-11-17(15,18)12-19/h3-6,8-10,15H,7,11H2,1-2H3/t15?,17-/m1/s1
InChIKey ABBNNCRIRQIRMW-OMOCHNIRSA-N
Molecular Weight 271.791 g/mol
SMILES C(C1[C@@](C#N)(Cl)CCC=C1)(=C(C)C)c1ccccc1
SPLASH splash10-0006-9820000000-ff4834e4438bd266ddd0
Source of Spectrum ES-2005-2267-12
Synonyms (1S)-1-chloro-2-(2-methyl-1-phenyl-1-propenyl)-3-cyclohexene-1-carbonitrile 1-Chloro-1-cyano-2-[(2'-methyl-1'-phenyl)prop-1'-enyl]cyclohex-3-ene
Wiley ID 1563403