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2,6-DIMETHYL-4-[(2,2-DICYANO-1-ETHOXYCARBONYL-1-TRIFLUOROMETHYL)ETHYL]ANILINE
SpectraBase Compound ID 86wDs478wL6
InChI InChI=1S/C16H16F3N3O2/c1-4-24-14(23)15(16(17,18)19,12(7-20)8-21)11-5-9(2)13(22)10(3)6-11/h5-6,12H,4,22H2,1-3H3
InChIKey KWOOLWRSQVVEHE-UHFFFAOYSA-N
Mol Weight 339.32 g/mol
Molecular Formula C16H16F3N3O2
Exact Mass 339.119461 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8rkcAfoto7T
Name 2,6-DIMETHYL-4-[(2,2-DICYANO-1-ETHOXYCARBONYL-1-TRIFLUOROMETHYL)ETHYL]ANILINE
Comments '+SIGMA-DOWNFIELD' IN THE PUBLICATION;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H16F3N3O2
InChI InChI=1S/C16H16F3N3O2/c1-4-24-14(23)15(16(17,18)19,12(7-20)8-21)11-5-9(2)13(22)10(3)6-11/h5-6,12H,4,22H2,1-3H3
InChIKey KWOOLWRSQVVEHE-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 C2D6SO dimethylsulfo