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5-Chloro-2-nitro-benzoic acid

Compound with spectra: 7 NMR, 6 FTIR, 1 Raman, and 1 MS (GC)

5-Chloro-2-nitro-benzoic acid
SpectraBase Compound ID 6tW3zRQzry2
InChI InChI=1S/C7H4ClNO4/c8-4-1-2-6(9(12)13)5(3-4)7(10)11/h1-3H,(H,10,11)
InChIKey ZKUYSJHXBFFGPU-UHFFFAOYSA-N
Mol Weight 201.56 g/mol
Molecular Formula C7H4ClNO4
Exact Mass 200.982885 g/mol

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1H NMR Spectrum
Copyright Copyright © 1991-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Solvent DMSO-d6; Reference=TMS; Temperature 297K

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1H NMR Spectrum
Copyright Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Solvent Acetone

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1H NMR Spectrum
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number C60201
Solvent CDCl3 & DMSO-d6

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FTIR Spectrum
Copyright Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved.
Technique KBr-Pellet

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FTIR Spectrum
Copyright Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number A12493
Technique KBr1

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FTIR Spectrum
Copyright Copyright © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number C60201
Technique Mull

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13C NMR Spectrum
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20

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13C NMR Spectrum
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Solvent DMSO-D6

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13C NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.

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13C NMR Spectrum
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number C60201
Solvent CDCl3 & DMSO-d6

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Raman Spectrum
Copyright Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number A12493

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ATR-IR Spectrum
Copyright Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number A12493

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ATR-IR Spectrum
Copyright Copyright © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Catalog Number C60201

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Vapor Phase IR Spectrum
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum O-21-230-8
  • 6-Nitro-3-chlorobenzoic acid
  • ZKUYSJHXBFFGPU-UHFFFAOYSA-N
  • Benzoic acid, 5-chloro-2-nitro-
  • 2-Nitro-5-chlorobenzoic acid
  • 3-Chloro-6-nitrobenzoic acid
  • EINECS 219-738-1
  • NSC 59735
4-Chloro-2-nitro-benzoic acid
4-Methyl-2-nitrobenzoic acid
4-Amino-2-nitrobenzoic acid
2-Nitro-m-toluic acid
N-Butyl-N-(5-chloro-2-nitrophenyl)amine
2-Amino-N-(bismethylamino-methylidenyl)-5-chloro-benzene-carboxamide
Benzoic acid, 2,2'-(1,3-propanediyldiimino)bis[5-fluoro-
4-Dimethylamino-2-nitrobenzaldehyde
3-allyl-4-nitrobenzonitrile
Benzoic acid, 2,2'-(1,3-propanediyldiimino)bis[5-bromo-
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