For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1-(Phenylethynyl)-1-benzylcyclohexane

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

1-(Phenylethynyl)-1-benzylcyclohexane
SpectraBase Compound ID Dpm7HqdCUYm
InChI InChI=1S/C21H22/c1-4-10-19(11-5-1)14-17-21(15-8-3-9-16-21)18-20-12-6-2-7-13-20/h1-2,4-7,10-13H,3,8-9,15-16,18H2
InChIKey IWAKVIGBPVXOSY-UHFFFAOYSA-N
Mol Weight 274.41 g/mol
Molecular Formula C21H22
Exact Mass 274.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DRNPFndSgzg
Name 1-(Phenylethynyl)-1-benzylcyclohexane
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22
InChI InChI=1S/C21H22/c1-4-10-19(11-5-1)14-17-21(15-8-3-9-16-21)18-20-12-6-2-7-13-20/h1-2,4-7,10-13H,3,8-9,15-16,18H2
InChIKey IWAKVIGBPVXOSY-UHFFFAOYSA-N
Molecular Weight 274.407 g/mol
SMILES C1(CCCCC1)(Cc1ccccc1)C#Cc1ccccc1
SPLASH splash10-0006-9030000000-bea91d7970d56586bbfa
Source of Spectrum F-62-2774-11
Synonyms {[1-(Phenylethynyl)cyclohexyl]methyl}benzene
Wiley ID 1632586