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1-(3,4-DIMETHOXYPHENYL)-2-AMINO-3-CYANO-4,4-BIS(TRIFLUOROMETHYL)-5,6-TRIMETHYLENE-1,4-DIHYDROPYRIDINE
SpectraBase Compound ID 1RYfNSqV9Xc
InChI InChI=1S/C19H17F6N3O2/c1-29-14-7-6-10(8-15(14)30-2)28-13-5-3-4-11(13)17(18(20,21)22,19(23,24)25)12(9-26)16(28)27/h6-8H,3-5,27H2,1-2H3
InChIKey YQMAGKQGRHCINI-UHFFFAOYSA-N
Mol Weight 433.35 g/mol
Molecular Formula C19H17F6N3O2
Exact Mass 433.122496 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FrkNcLDXPoA
Name 1-(3,4-DIMETHOXYPHENYL)-2-AMINO-3-CYANO-4,4-BIS(TRIFLUOROMETHYL)-5,6-TRIMETHYLENE-1,4-DIHYDROPYRIDINE
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Formula C19H17F6N3O2
InChI InChI=1S/C19H17F6N3O2/c1-29-14-7-6-10(8-15(14)30-2)28-13-5-3-4-11(13)17(18(20,21)22,19(23,24)25)12(9-26)16(28)27/h6-8H,3-5,27H2,1-2H3
InChIKey YQMAGKQGRHCINI-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 C3D6O acetone-d6