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alpha,alpha,alpha-TRIFLUOROTOLUENE
SpectraBase Compound ID BQQFbpyzZm6
InChI InChI=1S/C7H5F3/c8-7(9,10)6-4-2-1-3-5-6/h1-5H
InChIKey GETTZEONDQJALK-UHFFFAOYSA-N
Mol Weight 146.11 g/mol
Molecular Formula C7H5F3
Exact Mass 146.034335 g/mol
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Catalog Number T63703
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Source of Sample Ega-Chemie GmbH & Co KG, Steinheim
Technique Cell
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Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number 102315
Technique Neat
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Catalog Number T63703
Technique Neat
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Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
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Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
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Source of Spectrum AA-0-818-3
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Source of Spectrum NW-749-0-0
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Source of Spectrum AA-0-819-1
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Source of Spectrum SRH-2022-8863-0
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Source of Spectrum QE-27-SM75-75-1 (DOI: 10.1002/chem.202101621)
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Source of Spectrum QE-27-SM81-81-1 (DOI: 10.1002/chem.202101621)
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Source of Spectrum QE-27-SM83-83-1 (DOI: 10.1002/chem.202101621)
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Source of Spectrum EK-1999-736-0
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Source of Spectrum O-30-1347-0
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Source of Spectrum SRH-2022-4925-0
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Source of Spectrum SRH-2022-6051-0
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Source of Sample Hooker Chemical Corporation, Niagara Falls, New York
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
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Solvent CDCL3
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Solvent CDCl3
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Solvent CDCl3
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Solvent DMSO
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Solvent THF
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Solvent Dioxane
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Solvent CH2Cl2
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Solvent Neat liquid
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Solvent CDCl3
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Solvent CDCl3
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Solvent C3D6O acetone-d6
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Solvent CDCl3 chloroform-d
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Solvent CDCl3
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Solvent CDCl3
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Solvent CDCl3
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Solvent CDCl3
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Solvent CDCl3
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Solvent CDCl3
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Solvent CDCl3
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Solvent CH2Cl2
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Solvent CDCl3
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Solvent CDCl3
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Solvent CDCl3
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Solvent CDCl3
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Solvent CDCl3
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Solvent CDCl3 chloroform-d
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Solvent CDCl3
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Solvent CDCl3
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Solvent CDCl3
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Solvent CDCl3
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Solvent CDCl3
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Solvent C6D6
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Solvent DMSO-D6
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Solvent CDCl3
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Solvent CDCl3:CCl4
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Solvent Unknown
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Solvent CDCl3
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Solvent DMSO-D6
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Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number T63703
Solvent CDCl3
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Source of Sample Hooker Chemical Company, Niagara Falls, New York
Solvent CCl4
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Catalog Number T63703
Solvent CDCl3
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Solvent Unknown
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Solvent CH2Cl2
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Solvent CDCl3
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Solvent C6D12
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Solvent C6D12
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Solvent C2H4Cl2 dichloroetha
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Catalog Number 102315
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Catalog Number 102315
  • Benzotrifluoride
  • Trifluoromethylbenzene
  • BENZOTRIFLUORID
  • GETTZEONDQJALK-UHFFFAOYSA-N
  • PHENYLMETHYLTRIFLUORIDE
  • 1-TRIFLUOROMETHYLCYCLOHEXENE
  • 3-TRIFLUOROMETHYLCYCLOHEXENE
  • TOLUENE, A,A,A-TRIFLUORO-,
  • Benzene, (trifluoromethyl)-
  • Trifluorotoluene
Title Journal or Book Year
Rate Constants for 1,2-Hydrogen Migration in Cyclohexylidene and in Substituted Cyclohexylidenes1 The Journal of Organic Chemistry 1999
15N NMR: Substituent effect analysis inpara-andmeta-substituted phenylhydrazines Magnetic Resonance in Chemistry 1994
Substituent effects on the N.M.R. spectra of carboxylic acid derivatives. III. Correlation of 13C N.M.R. spectra of para substituted acetanilides and 4'-nitrophenyl 4-substituted benzoates with infrared carbonyl stretching frequencies, 1H N.M.R., rate and equilibrium data Australian Journal of Chemistry 1984
Fluorine magnetic resonance spectra of monofluoro- and difluoro-substituted hydrocarbons The Journal of Organic Chemistry 1980
Electronic effects of halogen-substituted methyl groups Australian Journal of Chemistry 1980
Studies on organic fluorine compounds. Part 27. Abnormal reactions in the trifluoromethylation of aromatic compounds with trifluoromethyl iodide and copper powder Journal of the Chemical Society, Perkin Transactions 1 1980
13C substituent effects in monosubstituted benzenes Organic Magnetic Resonance 1979
Carbon-13-fluorine-19 coupling constants in benzotrifluorides Organic Magnetic Resonance 1977
13C nuclear magnetic resonance studies of some fluorinated and trifluoromethylated aromatic compounds. Studies on13C–19F coupling constants J. Chem. Soc., Perkin Trans. 2 1976

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