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1-PHENYL-3-PENTAFLUOROETHYL-4-TRIFLUOROMETHYL-5-AMINOPYRAZOLE
SpectraBase Compound ID 7cA7z0P1y3V
InChI InChI=1S/C12H7F8N3/c13-10(14,12(18,19)20)8-7(11(15,16)17)9(21)23(22-8)6-4-2-1-3-5-6/h1-5H,21H2
InChIKey KJVVXLRLIRAURI-UHFFFAOYSA-N
Mol Weight 345.2 g/mol
Molecular Formula C12H7F8N3
Exact Mass 345.051223 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Ih0rERSTMJ
Name 1-PHENYL-3-PENTAFLUOROETHYL-4-TRIFLUOROMETHYL-5-AMINOPYRAZOLE
Comments SCALE INVERTED;R-32 (PERKIN-ELMER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H7F8N3
InChI InChI=1S/C12H7F8N3/c13-10(14,12(18,19)20)8-7(11(15,16)17)9(21)23(22-8)6-4-2-1-3-5-6/h1-5H,21H2
InChIKey KJVVXLRLIRAURI-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 CCl4 carbon tetrachl