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(E)-N-(3-methylphenyl)-3-[5-(4-nitrophenyl)-2-furanyl]-2-propenamide
SpectraBase Compound ID Ea5VbpAaE7N
InChI InChI=1S/C20H16N2O4/c1-14-3-2-4-16(13-14)21-20(23)12-10-18-9-11-19(26-18)15-5-7-17(8-6-15)22(24)25/h2-13H,1H3,(H,21,23)/b12-10+
InChIKey MUXPMDIBABNGOE-ZRDIBKRKSA-N
Mol Weight 348.36 g/mol
Molecular Formula C20H16N2O4
Exact Mass 348.111007 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JQu2iU2Ap7G
Name (E)-N-(3-Methylphenyl)-3-[5-(4-nitrophenyl)-2-furanyl]-2-propenamide
Comments Computed using HOSE algorithm
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Exact Mass 348.111006999 u
Formula C20H16N2O4
InChI InChI=1S/C20H16N2O4/c1-14-3-2-4-16(13-14)21-20(23)12-10-18-9-11-19(26-18)15-5-7-17(8-6-15)22(24)25/h2-13H,1H3,(H,21,23)/b12-10+
InChIKey MUXPMDIBABNGOE-ZRDIBKRKSA-N
Molecular Weight 348.358 g/mol
SMILES CC=1C=C(NC(\C=C\C=2OC(C3=CC=C(N(=O)=O)C=C3)=CC2)=O)C=CC1