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3-Fluoro-5-(trifluoromethyl)benzoic acid
SpectraBase Compound ID 3uitQWpYne9
InChI InChI=1S/C8H4F4O2/c9-6-2-4(7(13)14)1-5(3-6)8(10,11)12/h1-3H,(H,13,14)
InChIKey NSGKIIGVPBTOBF-UHFFFAOYSA-N
Mol Weight 208.11 g/mol
Molecular Formula C8H4F4O2
Exact Mass 208.014742 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Az0MECdcBDh
Name 3-Fluoro-5-(trifluoromethyl)benzoic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 455326
CAS Registry Number 161622-05-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H4F4O2
InChI InChI=1S/C8H4F4O2/c9-6-2-4(7(13)14)1-5(3-6)8(10,11)12/h1-3H,(H,13,14)
InChIKey NSGKIIGVPBTOBF-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_010034