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m-Bromo-alpha,alpha,alpha-trifluorotoluene

View entire compound with spectra: 15 NMR, 5 FTIR, 1 Raman, 2 MS (GC), and 2 Near IR

m-Bromo-alpha,alpha,alpha-trifluorotoluene
SpectraBase Compound ID BHloYJJl2rE
InChI InChI=1S/C7H4BrF3/c8-6-3-1-2-5(4-6)7(9,10)11/h1-4H
InChIKey NNMBNYHMJRJUBC-UHFFFAOYSA-N
Mol Weight 225.01 g/mol
Molecular Formula C7H4BrF3
Exact Mass 223.944848 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FETZTbiZiug
Name 3-Bromobenzotrifluoride
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number B59004
CAS Registry Number 401-78-5
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4BrF3
InChI 1S/C7H4BrF3/c8-6-3-1-2-5(4-6)7(9,10)11/h1-4H
InChIKey NNMBNYHMJRJUBC-UHFFFAOYSA-N
Observed nucleus 13C
Purity 99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 1-Bromo-3-(trifluoromethyl)benzene; 3-Bromo-alpha,alpha,alpha-trifluorotoluene
Wiley ID SIAL_13CNMR_010899