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2,3,6-Trifluorobenzoic acid
SpectraBase Compound ID JSKIJgfuBTA
InChI InChI=1S/C7H3F3O2/c8-3-1-2-4(9)6(10)5(3)7(11)12/h1-2H,(H,11,12)
InChIKey MGUPHQGQNHDGNK-UHFFFAOYSA-N
Mol Weight 176.09 g/mol
Molecular Formula C7H3F3O2
Exact Mass 176.008514 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1eKgJQvs3nl
Name 2,3,6-Trifluorobenzoic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 325198
CAS Registry Number 2358-29-4
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H3F3O2
InChI InChI=1S/C7H3F3O2/c8-3-1-2-4(9)6(10)5(3)7(11)12/h1-2H,(H,11,12)
InChIKey MGUPHQGQNHDGNK-UHFFFAOYSA-N
Observed nucleus 13C
Purity 99%
Solvent CDCl3 & DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_006472