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Propenamide, 2-(4-bromobenzoylamino)-3-phenyl-N-(4-methylphenyl)-
SpectraBase Compound ID 3v8LfZCasEA
InChI InChI=1S/C23H19BrN2O2/c1-16-7-13-20(14-8-16)25-23(28)21(15-17-5-3-2-4-6-17)26-22(27)18-9-11-19(24)12-10-18/h2-15H,1H3,(H,25,28)(H,26,27)/b21-15+
InChIKey XHJKCFCQQCIQSY-RCCKNPSSSA-N
Mol Weight 435.32 g/mol
Molecular Formula C23H19BrN2O2
Exact Mass 434.062991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DHzoFOxBsWo
Name Propenamide, 2-(4-bromobenzoylamino)-3-phenyl-N-(4-methylphenyl)-
Comments Computed using HOSE algorithm
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Exact Mass 434.062990858 u
Formula C23H19BrN2O2
InChI InChI=1S/C23H19BrN2O2/c1-16-7-13-20(14-8-16)25-23(28)21(15-17-5-3-2-4-6-17)26-22(27)18-9-11-19(24)12-10-18/h2-15H,1H3,(H,25,28)(H,26,27)/b21-15+
InChIKey XHJKCFCQQCIQSY-RCCKNPSSSA-N
Molecular Weight 435.321 g/mol
SMILES C(\C(NC(C1=CC=C(C=C1)Br)=O)=C/C=1C=CC=CC1)(NC=1C=CC(C)=CC1)=O