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1-PHENYL-3-PENTAFLUOROETHYL-4-TRIFLUOROMETHYL-5-CYCLOHEXYLAMINOPYRAZOLE
SpectraBase Compound ID 5wngCFSmJMI
InChI InChI=1S/C18H17F8N3/c19-16(20,18(24,25)26)14-13(17(21,22)23)15(27-11-7-3-1-4-8-11)29(28-14)12-9-5-2-6-10-12/h2,5-6,9-11,27H,1,3-4,7-8H2
InChIKey HCYYJGXYQDJSST-UHFFFAOYSA-N
Mol Weight 427.34 g/mol
Molecular Formula C18H17F8N3
Exact Mass 427.129473 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EVx9BiPycdu
Name 1-PHENYL-3-PENTAFLUOROETHYL-4-TRIFLUOROMETHYL-5-CYCLOHEXYLAMINOPYRAZOLE
Comments THE DOUBLING OF SIGNAL REASON IS NOT EXPLANED. SCALE INVERTED;R-32 (PERKIN-ELMER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H17F8N3
InChI InChI=1S/C18H17F8N3/c19-16(20,18(24,25)26)14-13(17(21,22)23)15(27-11-7-3-1-4-8-11)29(28-14)12-9-5-2-6-10-12/h2,5-6,9-11,27H,1,3-4,7-8H2
InChIKey HCYYJGXYQDJSST-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 CDCl3 chloroform-d