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3,5-Difluorobenzoic acid

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

3,5-Difluorobenzoic acid
SpectraBase Compound ID HvVZTGaphe9
InChI InChI=1S/C7H4F2O2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,(H,10,11)
InChIKey GONAVIHGXFBTOZ-UHFFFAOYSA-N
Mol Weight 158.1 g/mol
Molecular Formula C7H4F2O2
Exact Mass 158.017936 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3tyK8kq5dNV
Name 3,5-Difluorobenzoic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 290181
CAS Registry Number 455-40-3
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4F2O2
InChI InChI=1S/C7H4F2O2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,(H,10,11)
InChIKey GONAVIHGXFBTOZ-UHFFFAOYSA-N
Observed nucleus 13C
Purity 97%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_005542