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6-AMINO-5-CYANO-4-METHOXYCARBONYL-4-TRIFLUOROMETHYL-4,5-DIHYDROPYRAZOLO-[3,4-B]PYRIDINE
SpectraBase Compound ID 9OO68VX53Ye
InChI InChI=1S/C10H8F3N5O2/c1-20-8(19)9(10(11,12)13)4(2-14)6(15)17-7-5(9)3-16-18-7/h3-4H,1H3,(H3,15,16,17,18)
InChIKey JVMSLAJSOCWMMJ-UHFFFAOYSA-N
Mol Weight 287.2 g/mol
Molecular Formula C10H8F3N5O2
Exact Mass 287.063009 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KwQ2Ixcv1xI
Name 6-AMINO-5-CYANO-4-METHOXYCARBONYL-4-TRIFLUOROMETHYL-4,5-DIHYDROPYRAZOLO-[3,4-B]PYRIDINE
Comments THERE IS REMARK '+SIGMA-DOWNFIELD' IN THE PUBLICATION;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H8F3N5O2
InChI InChI=1S/C10H8F3N5O2/c1-20-8(19)9(10(11,12)13)4(2-14)6(15)17-7-5(9)3-16-18-7/h3-4H,1H3,(H3,15,16,17,18)
InChIKey JVMSLAJSOCWMMJ-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference V.Y.TYUTIN, N.D.CHKANIKOV, A.F.KOLOMIETS, A.V.FOKIN (1991) J.Fluor.Chem.: v.51,N3, 323-334.
NMR Standard CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6