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Trans-cinnamamide, N-(4-methoxyphenyl)-3-trifluoromethyl-
SpectraBase Compound ID ImxJLkF1cW1
InChI InChI=1S/C17H14F3NO2/c1-23-15-8-6-14(7-9-15)21-16(22)10-5-12-3-2-4-13(11-12)17(18,19)20/h2-11H,1H3,(H,21,22)/b10-5+
InChIKey CBNQBQRHCQWJHR-BJMVGYQFSA-N
Mol Weight 321.3 g/mol
Molecular Formula C17H14F3NO2
Exact Mass 321.097663 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1KcYAk20S14
Name Trans-cinnamamide, N-(4-methoxyphenyl)-3-trifluoromethyl-
Comments Computed using HOSE algorithm
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Exact Mass 321.097663182 u
Formula C17H14F3NO2
InChI InChI=1S/C17H14F3NO2/c1-23-15-8-6-14(7-9-15)21-16(22)10-5-12-3-2-4-13(11-12)17(18,19)20/h2-11H,1H3,(H,21,22)/b10-5+
InChIKey CBNQBQRHCQWJHR-BJMVGYQFSA-N
Molecular Weight 321.299 g/mol
SMILES C1(=CC=CC(=C1)\C=C\C(NC1=CC=C(OC)C=C1)=O)C(F)(F)F