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4-Bromobenzotrifluoride

View entire compound with spectra: 12 NMR, 7 FTIR, 2 Raman, and 3 MS (GC)

4-Bromobenzotrifluoride
SpectraBase Compound ID FEpYaxi4QkI
InChI InChI=1S/C7H4BrF3/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H
InChIKey XLQSXGGDTHANLN-UHFFFAOYSA-N
Mol Weight 225.01 g/mol
Molecular Formula C7H4BrF3
Exact Mass 223.944848 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3HnRHBepkca
Name p-BROMO-alpha,alpha,alpha-TRIFLUOROTOLUENE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Boiling Point 154-155C
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4BrF3
InChI InChI=1S/C7H4BrF3/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H
InChIKey XLQSXGGDTHANLN-UHFFFAOYSA-N
Molecular Weight 225.01
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms TOLUENE, 4-BROMO-A,A,A-TRIFLUORO-,