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(2E)-3-(1,3-benzodioxol-5-yl)-N-(6-methyl-2-pyridinyl)-2-propenamide
SpectraBase Compound ID IuL1kBilDko
InChI InChI=1S/C16H14N2O3/c1-11-3-2-4-15(17-11)18-16(19)8-6-12-5-7-13-14(9-12)21-10-20-13/h2-9H,10H2,1H3,(H,17,18,19)/b8-6+
InChIKey UEVHPZCCBWEPEN-SOFGYWHQSA-N
Mol Weight 282.3 g/mol
Molecular Formula C16H14N2O3
Exact Mass 282.100442 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KFur3oLr7OX
Name (2E)-3-(1,3-Benzodioxol-5-yl)-N-(6-methyl-2-pyridinyl)-2-propenamide
Comments Computed using HOSE algorithm
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Exact Mass 282.100442316 u
Formula C16H14N2O3
InChI InChI=1S/C16H14N2O3/c1-11-3-2-4-15(17-11)18-16(19)8-6-12-5-7-13-14(9-12)21-10-20-13/h2-9H,10H2,1H3,(H,17,18,19)/b8-6+
InChIKey UEVHPZCCBWEPEN-SOFGYWHQSA-N
Molecular Weight 282.299 g/mol
SMILES N(C1=NC(C)=CC=C1)C(\C=C\C=1C=C2OCOC2=CC1)=O