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1-PHENYL-3-PENTAFLUOROETHYL-4-TRIFLUOROMETHYL-5-FLUOROPYRAZOLE
SpectraBase Compound ID DuKrg3FyS48
InChI InChI=1S/C12H5F9N2/c13-9-7(11(16,17)18)8(10(14,15)12(19,20)21)22-23(9)6-4-2-1-3-5-6/h1-5H
InChIKey WOEYQBUTVGYDLU-UHFFFAOYSA-N
Mol Weight 348.17 g/mol
Molecular Formula C12H5F9N2
Exact Mass 348.030902 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CqD5vNEIYg3
Name 1-PHENYL-3-PENTAFLUOROETHYL-4-TRIFLUOROMETHYL-5-FLUOROPYRAZOLE
Comments SCALE INVERTED;R-32 (PERKIN-ELMER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H5F9N2
InChI InChI=1S/C12H5F9N2/c13-9-7(11(16,17)18)8(10(14,15)12(19,20)21)22-23(9)6-4-2-1-3-5-6/h1-5H
InChIKey WOEYQBUTVGYDLU-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference M.D.BAGRAMOVA, S.M.MOTSISHKITE, I.L.KNUNYANTS (1990) Izv.Akad.Nauk SSSR(Russ.Lang.): N11, 2583-2589.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported