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1-(PARA-CARBOXYPHENYL)-2-AMINO-3-CYANO-4,4-BIS(TRIFLUOROMETHYL)-6-METHYL-1,4-DIHYDROPYRIDINE

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1-(PARA-CARBOXYPHENYL)-2-AMINO-3-CYANO-4,4-BIS(TRIFLUOROMETHYL)-6-METHYL-1,4-DIHYDROPYRIDINE
SpectraBase Compound ID IIKmkOFr5ET
InChI InChI=1S/C16H11F6N3O2/c1-8-6-14(15(17,18)19,16(20,21)22)11(7-23)12(24)25(8)10-4-2-9(3-5-10)13(26)27/h2-6H,24H2,1H3,(H,26,27)
InChIKey FKTQBKBKQBRDFD-UHFFFAOYSA-N
Mol Weight 391.27 g/mol
Molecular Formula C16H11F6N3O2
Exact Mass 391.075546 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Toucz1tpGq
Name 1-(PARA-CARBOXYPHENYL)-2-AMINO-3-CYANO-4,4-BIS(TRIFLUOROMETHYL)-6-METHYL-1,4-DIHYDROPYRIDINE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H11F6N3O2
InChI InChI=1S/C16H11F6N3O2/c1-8-6-14(15(17,18)19,16(20,21)22)11(7-23)12(24)25(8)10-4-2-9(3-5-10)13(26)27/h2-6H,24H2,1H3,(H,26,27)
InChIKey FKTQBKBKQBRDFD-UHFFFAOYSA-N
Instrument Name Bruker AC-200
Literature Reference V.YU.TYUTIN, V.N.NESTEROV, M.YU.ANTIPIN, YU.T.STRUCHKOV, A.F.KOLOMIETS,A.V.FOKIN (1993) Izv.Akad.Nauk SSSR(Russ. Lang.): N3, 552-559.
NMR Standard CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2D6SO dimethylsulfo