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2-(Trifluoromethyl)phenylboronic acid

View entire compound with spectra: 2 NMR, 3 FTIR, and 1 Raman

2-(Trifluoromethyl)phenylboronic acid
SpectraBase Compound ID K9NI3lC3jRT
InChI InChI=1S/C7H6BF3O2/c9-7(10,11)5-3-1-2-4-6(5)8(12)13/h1-4,12-13H
InChIKey JNSBEPKGFVENFS-UHFFFAOYSA-N
Mol Weight 189.9 g/mol
Molecular Formula C7H6BF3O2
Exact Mass 190.041294 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5EsT9idRu0j
Name 2-(Trifluoromethyl)phenylboronic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 445193
CAS Registry Number 1423-27-4
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6BF3O2
InChI InChI=1S/C7H6BF3O2/c9-7(10,11)5-3-1-2-4-6(5)8(12)13/h1-4,12-13H
InChIKey JNSBEPKGFVENFS-UHFFFAOYSA-N
Observed nucleus 13C
Purity >=95.0%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_009784