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2,5-Dichlorobenzoic acid

View entire compound with spectra: 6 NMR, 5 FTIR, 1 Raman, and 2 MS (GC)

2,5-Dichlorobenzoic acid
SpectraBase Compound ID BSeFktzmZYS
InChI InChI=1S/C7H4Cl2O2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,(H,10,11)
InChIKey QVTQYSFCFOGITD-UHFFFAOYSA-N
Mol Weight 191.01 g/mol
Molecular Formula C7H4Cl2O2
Exact Mass 189.958835 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8Ann5ObwU4y
Name 2,5-Dichlorobenzoic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 144940
CAS Registry Number 50-79-3
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4Cl2O2
InChI InChI=1S/C7H4Cl2O2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,(H,10,11)
InChIKey QVTQYSFCFOGITD-UHFFFAOYSA-N
Observed nucleus 13C
Purity 97%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_001318