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

*Links on SpectraBase are not permalinks.

HYDROCINNAMIC ACID, B-METHYL-,

View entire compound with spectra: 8 NMR, 6 FTIR, 1 Raman, and 3 MS (GC)

HYDROCINNAMIC ACID, B-METHYL-,
SpectraBase Compound ID PuQrPkM5MX
InChI InChI=1S/C10H12O2/c1-8(7-10(11)12)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,11,12)
InChIKey ZZEWMYILWXCRHZ-UHFFFAOYSA-N
Mol Weight 164.2 g/mol
Molecular Formula C10H12O2
Exact Mass 164.08373 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 4MDVmlS4jqD
Name 3-Phenylbutyric acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 116807
CAS Registry Number 4593-90-2
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O2
InChI InChI=1S/C10H12O2/c1-8(7-10(11)12)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,11,12)
InChIKey ZZEWMYILWXCRHZ-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms (+/-)-3-Phenylbutyric acid (+/-)-beta-Methylhydrocinnamic acid
Wiley ID SIAL_13CNMR_000488