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2'-{[(3-pyridyl)methyl]carbamoyl}-2-furanilide
SpectraBase Compound ID IdXzGBk6P5z
InChI InChI=1S/C18H15N3O3/c22-17(20-12-13-5-3-9-19-11-13)14-6-1-2-7-15(14)21-18(23)16-8-4-10-24-16/h1-11H,12H2,(H,20,22)(H,21,23)
InChIKey AIKPUWAFLPLSOI-UHFFFAOYSA-N
Mol Weight 321.34 g/mol
Molecular Formula C18H15N3O3
Exact Mass 321.111341 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 79MkJT0lTSc
Name 2'-{[(3-pyridyl)methyl]carbamoyl}-2-furanilide
Comments Computed using HOSE algorithm
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Exact Mass 321.111341352 u
Formula C18H15N3O3
InChI InChI=1S/C18H15N3O3/c22-17(20-12-13-5-3-9-19-11-13)14-6-1-2-7-15(14)21-18(23)16-8-4-10-24-16/h1-11H,12H2,(H,20,22)(H,21,23)
InChIKey AIKPUWAFLPLSOI-UHFFFAOYSA-N
Molecular Weight 321.336 g/mol
SMILES N(C(C=1C(=CC=CC1)NC(C=1OC=CC1)=O)=O)CC=1C=CC=NC1