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

*Links on SpectraBase are not permalinks.

4-(4-Methylcyclohexylidene)butanoic acid

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

4-(4-Methylcyclohexylidene)butanoic acid
SpectraBase Compound ID GloytmhzO3P
InChI InChI=1S/C11H18O2/c1-9-5-7-10(8-6-9)3-2-4-11(12)13/h3,9H,2,4-8H2,1H3,(H,12,13)/b10-3-
InChIKey YYPPDTGZDNDQLM-KMKOMSMNSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 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 KBPfpbyKrbE
Name 4-(4-Methylcyclohexylidene)butanoic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 182.130679818 u
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-9-5-7-10(8-6-9)3-2-4-11(12)13/h3,9H,2,4-8H2,1H3,(H,12,13)/b10-3-
InChIKey YYPPDTGZDNDQLM-KMKOMSMNSA-N
Molecular Weight 182.263 g/mol
SMILES C1(=CCCC(=O)O)CCC(CC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.971431