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Trans-cinnamamide, 3-trifluoromethyl-N-benzyl-N-nonyl-
SpectraBase Compound ID 9P7ZhLsB56Y
InChI InChI=1S/C26H32F3NO/c1-2-3-4-5-6-7-11-19-30(21-23-13-9-8-10-14-23)25(31)18-17-22-15-12-16-24(20-22)26(27,28)29/h8-10,12-18,20H,2-7,11,19,21H2,1H3/b18-17+
InChIKey GITCTIHVESPEQT-ISLYRVAYSA-N
Mol Weight 431.5 g/mol
Molecular Formula C26H32F3NO
Exact Mass 431.243599 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5oSuarhBVwp
Name Trans-cinnamamide, 3-trifluoromethyl-N-benzyl-N-nonyl-
Comments Computed using HOSE algorithm
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Exact Mass 431.243599142 u
Formula C26H32F3NO
InChI InChI=1S/C26H32F3NO/c1-2-3-4-5-6-7-11-19-30(21-23-13-9-8-10-14-23)25(31)18-17-22-15-12-16-24(20-22)26(27,28)29/h8-10,12-18,20H,2-7,11,19,21H2,1H3/b18-17+
InChIKey GITCTIHVESPEQT-ISLYRVAYSA-N
Molecular Weight 431.543 g/mol
SMILES C(N(CCCCCCCCC)CC1=CC=CC=C1)(=O)\C=C\C1=CC=CC(=C1)C(F)(F)F