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Trans-cinnamamide, 3-trifluoromethyl-N-allyl-N-tetradecyl-
SpectraBase Compound ID JzEGnnFEV3q
InChI InChI=1S/C27H40F3NO/c1-3-5-6-7-8-9-10-11-12-13-14-15-22-31(21-4-2)26(32)20-19-24-17-16-18-25(23-24)27(28,29)30/h4,16-20,23H,2-3,5-15,21-22H2,1H3/b20-19+
InChIKey VOEKLKXKAKEIOM-FMQUCBEESA-N
Mol Weight 451.6 g/mol
Molecular Formula C27H40F3NO
Exact Mass 451.306199 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3GEeYsXeA5w
Name Trans-cinnamamide, 3-trifluoromethyl-N-allyl-N-tetradecyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 451.306199400 u
Formula C27H40F3NO
InChI InChI=1S/C27H40F3NO/c1-3-5-6-7-8-9-10-11-12-13-14-15-22-31(21-4-2)26(32)20-19-24-17-16-18-25(23-24)27(28,29)30/h4,16-20,23H,2-3,5-15,21-22H2,1H3/b20-19+
InChIKey VOEKLKXKAKEIOM-FMQUCBEESA-N
Molecular Weight 451.618 g/mol
SMILES C(N(CCCCCCCCCCCCCC)CC=C)(=O)\C=C\C1=CC=CC(=C1)C(F)(F)F