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4-(4-Butylcyclohexyl)benzonitrile
SpectraBase Compound ID 8IahZaxQVdW
InChI InChI=1S/C17H23N/c1-2-3-4-14-5-9-16(10-6-14)17-11-7-15(13-18)8-12-17/h7-8,11-12,14,16H,2-6,9-10H2,1H3
InChIKey YYAVXASAKUOZJJ-UHFFFAOYSA-N
Mol Weight 241.38 g/mol
Molecular Formula C17H23N
Exact Mass 241.18305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LDb3ysXzvH9
Name 4-(4-Butylcyclohexyl)benzonitrile
CAS Registry Number 61204-00-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23N
InChI InChI=1S/C17H23N/c1-2-3-4-14-5-9-16(10-6-14)17-11-7-15(13-18)8-12-17/h7-8,11-12,14,16H,2-6,9-10H2,1H3
InChIKey YYAVXASAKUOZJJ-UHFFFAOYSA-N
Molecular Weight 241.378 g/mol
SMILES c1c(ccc(C#N)c1)C1CCC(CCCC)CC1
SPLASH splash10-00mo-5900000000-893869196b9f5b3084cb
Source of Spectrum O-25-551-3
Synonyms 4-(4-Butylcyclohexyl)benzenecarbonitrile Benzonitrile, 4-(4-butylcyclohexyl)- Benzonitrile, 4-(trans-4-butylcyclohexyl)- p-(4-Butylcyclohexyl)benzonitrile trans-4-(4-Butylcyclohexyl)benzonitrile trans-4-butyl-1-(4-cyanophenyl)cyclohexane EINECS 262-655-0
Wiley ID 1244372