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Trans-cinnamamide, N,N-dioctyl-3-trifluoromethyl-
SpectraBase Compound ID A0zJZAmNmEw
InChI InChI=1S/C26H40F3NO/c1-3-5-7-9-11-13-20-30(21-14-12-10-8-6-4-2)25(31)19-18-23-16-15-17-24(22-23)26(27,28)29/h15-19,22H,3-14,20-21H2,1-2H3/b19-18+
InChIKey KNZBFZBYARYENM-VHEBQXMUSA-N
Mol Weight 439.6 g/mol
Molecular Formula C26H40F3NO
Exact Mass 439.306199 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GQTunB6N6nF
Name Trans-cinnamamide, N,N-dioctyl-3-trifluoromethyl-
Comments Computed using HOSE algorithm
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Exact Mass 439.306199400 u
Formula C26H40F3NO
InChI InChI=1S/C26H40F3NO/c1-3-5-7-9-11-13-20-30(21-14-12-10-8-6-4-2)25(31)19-18-23-16-15-17-24(22-23)26(27,28)29/h15-19,22H,3-14,20-21H2,1-2H3/b19-18+
InChIKey KNZBFZBYARYENM-VHEBQXMUSA-N
Molecular Weight 439.607 g/mol
SMILES C1(=CC=CC(=C1)\C=C\C(N(CCCCCCCC)CCCCCCCC)=O)C(F)(F)F