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4-Chloro-3-nitrobenzoic acid

View entire compound with spectra: 7 NMR, 5 FTIR, 1 Raman, 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) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IDchXtQKDFU
Name 4-CHLORO-3-NITRO-BENZOIC-ACID
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. 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
Literature Reference Author K.KNEPPER,S.BRASE
Literature Reference Citation ORG.LETTERS,5,2829(2003)
Literature Reference DOI 10.1021/ol034851y
Molecular Weight 201.566 g/mol
Sample ID 38141
Solvent CD3OD