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1,4-Bis(trifluoromethyl)benzene

View entire compound with spectra: 17 NMR, 4 FTIR, 1 Raman, and 2 MS (GC)

1,4-Bis(trifluoromethyl)benzene
SpectraBase Compound ID 3PGgGfdVfFd
InChI InChI=1S/C8H4F6/c9-7(10,11)5-1-2-6(4-3-5)8(12,13)14/h1-4H
InChIKey PDCBZHHORLHNCZ-UHFFFAOYSA-N
Mol Weight 214.11 g/mol
Molecular Formula C8H4F6
Exact Mass 214.021719 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FgObtWpXpn6
Name 1,4-Bis(trifluoromethyl)-benzene
CAS Registry Number 433-19-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H4F6
InChI InChI=1S/C8H4F6/c9-7(10,11)5-1-2-6(4-3-5)8(12,13)14/h1-4H
InChIKey PDCBZHHORLHNCZ-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference D. Doddrell, M. Barfield, W. Adcock, J. Chem. Soc. Perkin II 1976, 402.
NMR Standard CS2
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3