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Trans-cinnamamide, 3-trifluoromethyl-N-(2-butyl)-N-(2-ethylhexyl)-
SpectraBase Compound ID GtiftRYyrmU
InChI InChI=1S/C22H32F3NO/c1-5-8-10-18(7-3)16-26(17(4)6-2)21(27)14-13-19-11-9-12-20(15-19)22(23,24)25/h9,11-15,17-18H,5-8,10,16H2,1-4H3/b14-13+
InChIKey XJJRDSUCZVCLJO-BUHFOSPRSA-N
Mol Weight 383.5 g/mol
Molecular Formula C22H32F3NO
Exact Mass 383.243599 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 56cPQfgIPMo
Name Trans-cinnamamide, 3-trifluoromethyl-N-(2-butyl)-N-(2-ethylhexyl)-
Comments Computed using HOSE algorithm
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Exact Mass 383.243599142 u
Formula C22H32F3NO
InChI InChI=1S/C22H32F3NO/c1-5-8-10-18(7-3)16-26(17(4)6-2)21(27)14-13-19-11-9-12-20(15-19)22(23,24)25/h9,11-15,17-18H,5-8,10,16H2,1-4H3/b14-13+
InChIKey XJJRDSUCZVCLJO-BUHFOSPRSA-N
Molecular Weight 383.499 g/mol
SMILES C(N(CC(CCCC)CC)C(CC)C)(=O)\C=C\C1=CC=CC(=C1)C(F)(F)F