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

*Links on SpectraBase are not permalinks.

2'-Chloro-cinnamic acid, methyl ester

View entire compound with spectra: 2 NMR, 1 FTIR, 1 Raman, and 1 MS (GC)

2'-Chloro-cinnamic acid, methyl ester
SpectraBase Compound ID 65XTvXg3Vyg
InChI InChI=1S/C10H9ClO2/c1-13-10(12)7-6-8-4-2-3-5-9(8)11/h2-7H,1H3/b7-6+
InChIKey POTRTUQCRHOIFM-VOTSOKGWSA-N
Mol Weight 196.63 g/mol
Molecular Formula C10H9ClO2
Exact Mass 196.029107 g/mol

Raman Spectrum

Raman Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID FdCW9ZcWF9G
Name 2'-Chlorocinnamic acid, methyl ester; 2-propenoic acid, 3-(2-chlorophenyl)-, methyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 196.029107228 u
Formula C10H9ClO2
InChI InChI=1S/C10H9ClO2/c1-13-10(12)7-6-8-4-2-3-5-9(8)11/h2-7H,1H3/b7-6+
InChIKey POTRTUQCRHOIFM-VOTSOKGWSA-N
Molecular Weight 196.633 g/mol
SMILES C(\C=C\C1=C(C=CC=C1)Cl)(OC)=O
Spectrum/Structure Validation Score (Raman) 0.953489