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4-(4-Propylcyclohexyl)benzonitrile

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4-(4-Propylcyclohexyl)benzonitrile
SpectraBase Compound ID CY8ROLKcARM
InChI InChI=1S/C16H21N/c1-2-3-13-4-8-15(9-5-13)16-10-6-14(12-17)7-11-16/h6-7,10-11,13,15H,2-5,8-9H2,1H3
InChIKey XXUSEPRYHRDKFV-UHFFFAOYSA-N
Mol Weight 227.35 g/mol
Molecular Formula C16H21N
Exact Mass 227.1674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Ekr4VwyLQ
Name 4-(4-Propylcyclohexyl)benzonitrile
Alternate Name(s) 4-(4-Propylcyclohexyl)benzenecarbonitrile 4-(trans-4-propylcyclohexyl)benzonitrile Benzonitrile, 4-(4-propylcyclohexyl)- Benzonitrile, 4-(trans-4-propylcyclohexyl)- trans-4-(4-Propylcyclohexyl)benzonitrile trans-4-propyl(4-cyanophenyl)cyclohexane EINECS 262-654-5
CAS Registry Number 62788-03-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21N
InChI InChI=1S/C16H21N/c1-2-3-13-4-8-15(9-5-13)16-10-6-14(12-17)7-11-16/h6-7,10-11,13,15H,2-5,8-9H2,1H3
InChIKey XXUSEPRYHRDKFV-UHFFFAOYSA-N
Molecular Weight 227.351 g/mol
SMILES c1c(ccc(C#N)c1)C1CCC(CCC)CC1
SPLASH splash10-00pl-6910000000-678f90d538e4d35bdf88
Wiley ID 1476194