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Trans-cinnamamide, 3-trifluoromethyl-N-(2-butyl)-N-nonyl-
SpectraBase Compound ID 5pVbtrgrh57
InChI InChI=1S/C23H34F3NO/c1-4-6-7-8-9-10-11-17-27(19(3)5-2)22(28)16-15-20-13-12-14-21(18-20)23(24,25)26/h12-16,18-19H,4-11,17H2,1-3H3/b16-15+
InChIKey RXHSMCVJMVDLCP-FOCLMDBBSA-N
Mol Weight 397.5 g/mol
Molecular Formula C23H34F3NO
Exact Mass 397.259249 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4gDyYhkfQHr
Name Trans-cinnamamide, 3-trifluoromethyl-N-(2-butyl)-N-nonyl-
Comments Computed using HOSE algorithm
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Exact Mass 397.259249207 u
Formula C23H34F3NO
InChI InChI=1S/C23H34F3NO/c1-4-6-7-8-9-10-11-17-27(19(3)5-2)22(28)16-15-20-13-12-14-21(18-20)23(24,25)26/h12-16,18-19H,4-11,17H2,1-3H3/b16-15+
InChIKey RXHSMCVJMVDLCP-FOCLMDBBSA-N
Molecular Weight 397.526 g/mol
SMILES C(N(CCCCCCCCC)C(CC)C)(=O)\C=C\C1=CC=CC(=C1)C(F)(F)F