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4-Chloro-3-nitrobenzoic acid

View entire compound with spectra: 7 NMR, 5 FTIR, and 4 MS (GC)

4-Chloro-3-nitrobenzoic acid
SpectraBase Compound ID KACfNQ7I43O
InChI InChI=1S/C7H4ClNO4/c8-5-2-1-4(7(10)11)3-6(5)9(12)13/h1-3H,(H,10,11)
InChIKey DFXQXFGFOLXAPO-UHFFFAOYSA-N
Mol Weight 201.56 g/mol
Molecular Formula C7H4ClNO4
Exact Mass 200.982885 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9AgtqK98jcn
Name 4-Chloro-3-nitrobenzoic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number C60007
CAS Registry Number 96-99-1
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4ClNO4
InChI InChI=1S/C7H4ClNO4/c8-5-2-1-4(7(10)11)3-6(5)9(12)13/h1-3H,(H,10,11)
InChIKey DFXQXFGFOLXAPO-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_011174