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2-BENZAMIDO-2-TRIFLUOROMETHYL-3-PHENYL-3-CARBOXY-N-(1-ETHOXYCARBONYL-2-PHENYLETHYL)PROPIONAMIDE (DIASTEREOMER MIXTURE)
SpectraBase Compound ID 1OS2BzYcOZj
InChI InChI=1S/C29H27F3N2O6/c1-2-40-26(38)22(18-19-12-6-3-7-13-19)33-27(39)28(29(30,31)32,34-24(35)21-16-10-5-11-17-21)23(25(36)37)20-14-8-4-9-15-20/h3-17,22-23H,2,18H2,1H3,(H,33,39)(H,34,35)(H,36,37)
InChIKey GBORGAZETAIVFL-UHFFFAOYSA-N
Mol Weight 556.54 g/mol
Molecular Formula C29H27F3N2O6
Exact Mass 556.182121 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FTA747QdGny
Name 2-BENZAMIDO-2-TRIFLUOROMETHYL-3-PHENYL-3-CARBOXY-N-(1-ETHOXYCARBONYL-2-PHENYLETHYL)PROPIONAMIDE (DIASTEREOMER MIXTURE)
Comments MAY BE C-60 (JEOL). NAME DEFINED. DISAGREEMENT BETWEEN BRUTTO-FORMULA
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C29H27F3N2O6
InChI InChI=1S/C29H27F3N2O6/c1-2-40-26(38)22(18-19-12-6-3-7-13-19)33-27(39)28(29(30,31)32,34-24(35)21-16-10-5-11-17-21)23(25(36)37)20-14-8-4-9-15-20/h3-17,22-23H,2,18H2,1H3,(H,33,39)(H,34,35)(H,36,37)
InChIKey GBORGAZETAIVFL-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference KLAUS BURGER, KARL GAA, EVA HOSS (1990) J.Fluor.Chem.: v.47, N1, 89-94.
NMR Standard CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6