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3-Chlorosalicylic acid

Compound with spectra: 4 NMR, and 2 FTIR

3-Chlorosalicylic acid
SpectraBase Compound ID Cz2QeeyENto
InChI InChI=1S/C7H5ClO3/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3,9H,(H,10,11)
InChIKey PPINMMULCRBDOS-UHFFFAOYSA-N
Mol Weight 172.57 g/mol
Molecular Formula C7H5ClO3
Exact Mass 171.992722 g/mol

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD

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13C NMR Spectrum
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 275697
Solvent DMSO-d6

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ATR-IR Spectrum
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Catalog Number 275697

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1H NMR Spectrum
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 275697
Solvent DMSO-d6

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FTIR Spectrum
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 275697
Technique Mull
  • PPINMMULCRBDOS-UHFFFAOYSA-N
2,3-Dihydroxy-benzoic acid
3-Chloro-2-methylbenzoic acid
2,3-Dichlorobenzoic acid
2-Amino-3-chlorobenzoic acid
5-Chlorosalicylic acid
3-Hydroxy-2-methylbenzoic acid
3,5-Dichlorosalicylaldehyde
3,5-Dichloro-4-hydroxybenzoic acid
4-Chlorosalicylic acid
3,5-dichloro-2-hydroxybenzyl alcohol
Title Journal or Book Year
1H and13C NMR spectral assignments of halogenated transformation products of pharmaceuticals and related environmental contaminants Magnetic Resonance in Chemistry 2014
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