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2-Fluoro-5-(trifluoromethyl)benzoic acid

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

2-Fluoro-5-(trifluoromethyl)benzoic acid
SpectraBase Compound ID F1zVKRmr1VY
InChI InChI=1S/C8H4F4O2/c9-6-2-1-4(8(10,11)12)3-5(6)7(13)14/h1-3H,(H,13,14)
InChIKey LIFKXWNFWIUMJT-UHFFFAOYSA-N
Mol Weight 208.11 g/mol
Molecular Formula C8H4F4O2
Exact Mass 208.014742 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5kEkZUI3V7e
Name 2-Fluoro-5-(trifluoromethyl)benzoic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 455253
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H4F4O2
InChI InChI=1S/C8H4F4O2/c9-6-2-1-4(8(10,11)12)3-5(6)7(13)14/h1-3H,(H,13,14)
InChIKey LIFKXWNFWIUMJT-UHFFFAOYSA-N
Molecular Weight 208.112 g/mol
Observed nucleus 1H
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_1HNMR_014486