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2,5-Dichloro-3-nitrobenzoic acid

View entire compound with spectra: 3 NMR, 4 FTIR, and 1 Raman

2,5-Dichloro-3-nitrobenzoic acid
SpectraBase Compound ID LfftH79YLB1
InChI InChI=1S/C7H3Cl2NO4/c8-3-1-4(7(11)12)6(9)5(2-3)10(13)14/h1-2H,(H,11,12)
InChIKey AUAXYMOBWXOEQD-UHFFFAOYSA-N
Mol Weight 236.01 g/mol
Molecular Formula C7H3Cl2NO4
Exact Mass 234.943913 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IN2WnEVeKg
Name 2,5-Dichloro-3-nitrobenzoic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 429848
CAS Registry Number 88-86-8
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H3Cl2NO4
InChI InChI=1S/C7H3Cl2NO4/c8-3-1-4(7(11)12)6(9)5(2-3)10(13)14/h1-2H,(H,11,12)
InChIKey AUAXYMOBWXOEQD-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_009504