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2,4,6-Trichlorobenzoic acid

View entire compound with spectra: 3 NMR, 1 FTIR, and 2 MS (GC)

2,4,6-Trichlorobenzoic acid
SpectraBase Compound ID 9K5ky0xiYFo
InChI InChI=1S/C7H3Cl3O2/c8-3-1-4(9)6(7(11)12)5(10)2-3/h1-2H,(H,11,12)
InChIKey RAFFVQBMVYYTQS-UHFFFAOYSA-N
Mol Weight 225.46 g/mol
Molecular Formula C7H3Cl3O2
Exact Mass 223.919862 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 23Apoeoxsqb
Name 2,4,6-Trichlorobenzoic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 344281
CAS Registry Number 50-43-1
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H3Cl3O2
InChI InChI=1S/C7H3Cl3O2/c8-3-1-4(9)6(7(11)12)5(10)2-3/h1-2H,(H,11,12)
InChIKey RAFFVQBMVYYTQS-UHFFFAOYSA-N
Observed nucleus 13C
Solvent CDCl3 & DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_007142