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

*Links on SpectraBase are not permalinks.

2-Methyl-3-(2-phenethyl)-5-(2-propenyl)cyclohexan-1-one

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

2-Methyl-3-(2-phenethyl)-5-(2-propenyl)cyclohexan-1-one
SpectraBase Compound ID LLBDGgxow7D
InChI InChI=1S/C18H24O/c1-3-7-16-12-17(14(2)18(19)13-16)11-10-15-8-5-4-6-9-15/h3-6,8-9,14,16-17H,1,7,10-13H2,2H3
InChIKey VKSLUQVIJUWCPV-UHFFFAOYSA-N
Mol Weight 256.39 g/mol
Molecular Formula C18H24O
Exact Mass 256.182715 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID G76dKogQm2F
Name 2-Methyl-3-(2-phenethyl)-5-(2-propenyl)cyclohexan-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 256.182715392 u
Formula C18H24O
InChI InChI=1S/C18H24O/c1-3-7-16-12-17(14(2)18(19)13-16)11-10-15-8-5-4-6-9-15/h3-6,8-9,14,16-17H,1,7,10-13H2,2H3
InChIKey VKSLUQVIJUWCPV-UHFFFAOYSA-N
Molecular Weight 256.389 g/mol
SMILES C1(C(C(CC(C1)CC=C)CCC1=CC=CC=C1)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.870117