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Trans-cinnamamide, 3-trifluoromethyl-N-benzyl-N-decyl-
SpectraBase Compound ID A0DSv1UHBRy
InChI InChI=1S/C27H34F3NO/c1-2-3-4-5-6-7-8-12-20-31(22-24-14-10-9-11-15-24)26(32)19-18-23-16-13-17-25(21-23)27(28,29)30/h9-11,13-19,21H,2-8,12,20,22H2,1H3/b19-18+
InChIKey GFDNHIIJPWURNR-VHEBQXMUSA-N
Mol Weight 445.6 g/mol
Molecular Formula C27H34F3NO
Exact Mass 445.259249 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1A8EW1wdOJn
Name Trans-cinnamamide, 3-trifluoromethyl-N-benzyl-N-decyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 445.259249207 u
Formula C27H34F3NO
InChI InChI=1S/C27H34F3NO/c1-2-3-4-5-6-7-8-12-20-31(22-24-14-10-9-11-15-24)26(32)19-18-23-16-13-17-25(21-23)27(28,29)30/h9-11,13-19,21H,2-8,12,20,22H2,1H3/b19-18+
InChIKey GFDNHIIJPWURNR-VHEBQXMUSA-N
Molecular Weight 445.570 g/mol
SMILES C(N(CCCCCCCCCC)CC1=CC=CC=C1)(=O)\C=C\C1=CC=CC(=C1)C(F)(F)F