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4-Amino-2-chloro-benzoic acid

View entire compound with spectra: 5 NMR, 4 FTIR, 2 Raman, and 1 MS (GC)

4-Amino-2-chloro-benzoic acid
SpectraBase Compound ID 3r4idtaSfFF
InChI InChI=1S/C7H6ClNO2/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3H,9H2,(H,10,11)
InChIKey MBDUKNCPOPMRJQ-UHFFFAOYSA-N
Mol Weight 171.58 g/mol
Molecular Formula C7H6ClNO2
Exact Mass 171.008706 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID L7g3pSBofRO
Name 4-Amino-2-chlorobenzoic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 217719
CAS Registry Number 2457-76-3
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6ClNO2
InChI 1S/C7H6ClNO2/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3H,9H2,(H,10,11)
InChIKey MBDUKNCPOPMRJQ-UHFFFAOYSA-N
Observed nucleus 1H
Purity 97%
Solvent CDCl3 & DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_1HNMR_003083