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

*Links on SpectraBase are not permalinks.

3-Chloro-4-methylcarbanilic acid, isopropyl ester

View entire compound with spectra: 3 NMR, 1 FTIR, and 1 Raman

3-Chloro-4-methylcarbanilic acid, isopropyl ester
SpectraBase Compound ID IuYBQW81o14
InChI InChI=1S/C11H14ClNO2/c1-7(2)15-11(14)13-9-5-4-8(3)10(12)6-9/h4-7H,1-3H3,(H,13,14)
InChIKey PJUNGEJMHKZHAV-UHFFFAOYSA-N
Mol Weight 227.69 g/mol
Molecular Formula C11H14ClNO2
Exact Mass 227.071306 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 KFfoUCotxqq
Name 3-Chloro-4-methylcarbanilic acid, isopropyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 227.071306393 u
Formula C11H14ClNO2
InChI InChI=1S/C11H14ClNO2/c1-7(2)15-11(14)13-9-5-4-8(3)10(12)6-9/h4-7H,1-3H3,(H,13,14)
InChIKey PJUNGEJMHKZHAV-UHFFFAOYSA-N
Molecular Weight 227.691 g/mol
SMILES N(C1=CC=C(C(=C1)Cl)C)C(OC(C)C)=O
Spectrum/Structure Validation Score (Raman) 0.884804