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

*Links on SpectraBase are not permalinks.

3-(4-Methoxyphenyl)-2-methylpent-4-enoic acid

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

3-(4-Methoxyphenyl)-2-methylpent-4-enoic acid
SpectraBase Compound ID B2qK8CcnNy1
InChI InChI=1S/C13H16O3/c1-4-12(9(2)13(14)15)10-5-7-11(16-3)8-6-10/h4-9,12H,1H2,2-3H3,(H,14,15)
InChIKey WHGSTAALBORMLM-UHFFFAOYSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 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 CvswJjP2yr8
Name 3-(4-Methoxyphenyl)-2-methylpent-4-enoic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 220.109944372 u
Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-4-12(9(2)13(14)15)10-5-7-11(16-3)8-6-10/h4-9,12H,1H2,2-3H3,(H,14,15)
InChIKey WHGSTAALBORMLM-UHFFFAOYSA-N
Molecular Weight 220.268 g/mol
SMILES C(C(C(C=1C=CC(=CC1)OC)C=C)C)(=O)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.809234