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N-((E)-2-(2-furyl)-1-{[3-(trifluoromethyl)anilino]carbonyl}ethenyl)benzamide

View entire compound with spectra: 2 NMR

N-((E)-2-(2-furyl)-1-{[3-(trifluoromethyl)anilino]carbonyl}ethenyl)benzamide
SpectraBase Compound ID HOptyOf1d8w
InChI InChI=1S/C21H15F3N2O3/c22-21(23,24)15-8-4-9-16(12-15)25-20(28)18(13-17-10-5-11-29-17)26-19(27)14-6-2-1-3-7-14/h1-13H,(H,25,28)(H,26,27)/b18-13+
InChIKey FOJUOWJDNPIEOJ-QGOAFFKASA-N
Mol Weight 400.36 g/mol
Molecular Formula C21H15F3N2O3
Exact Mass 400.103477 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9JPU3lFWpli
Name N-((E)-2-(2-Furyl)-1-{[3-(trifluoromethyl)anilino]carbonyl}ethenyl)benzamide
Comments Computed using HOSE algorithm
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Exact Mass 400.103476837 u
Formula C21H15F3N2O3
InChI InChI=1S/C21H15F3N2O3/c22-21(23,24)15-8-4-9-16(12-15)25-20(28)18(13-17-10-5-11-29-17)26-19(27)14-6-2-1-3-7-14/h1-13H,(H,25,28)(H,26,27)/b18-13+
InChIKey FOJUOWJDNPIEOJ-QGOAFFKASA-N
Molecular Weight 400.357 g/mol
SMILES N(C(\C(=C/C=1OC=CC1)NC(=O)C1=CC=CC=C1)=O)C1=CC(=CC=C1)C(F)(F)F