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Trans-cinnamamide, N-heptyl-N-octyl-3-trifluoromethyl-

View entire compound with spectra: 1 NMR, and 1 FTIR

Trans-cinnamamide, N-heptyl-N-octyl-3-trifluoromethyl-
SpectraBase Compound ID 6jfQicK7DHy
InChI InChI=1S/C25H38F3NO/c1-3-5-7-9-11-13-20-29(19-12-10-8-6-4-2)24(30)18-17-22-15-14-16-23(21-22)25(26,27)28/h14-18,21H,3-13,19-20H2,1-2H3/b18-17+
InChIKey BQDWRCAUWXEUTQ-ISLYRVAYSA-N
Mol Weight 425.6 g/mol
Molecular Formula C25H38F3NO
Exact Mass 425.290549 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EnLrvCVOyki
Name Trans-cinnamamide, N-heptyl-N-octyl-3-trifluoromethyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 425.290549336 u
Formula C25H38F3NO
InChI InChI=1S/C25H38F3NO/c1-3-5-7-9-11-13-20-29(19-12-10-8-6-4-2)24(30)18-17-22-15-14-16-23(21-22)25(26,27)28/h14-18,21H,3-13,19-20H2,1-2H3/b18-17+
InChIKey BQDWRCAUWXEUTQ-ISLYRVAYSA-N
Molecular Weight 425.580 g/mol
SMILES C1(=CC=CC(=C1)\C=C\C(N(CCCCCCC)CCCCCCCC)=O)C(F)(F)F