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2(1H)-imino-5-methyl-1-(4'-phenylphenacyl)pyridine
SpectraBase Compound ID 4abmdzJSjd3
InChI InChI=1S/C20H18N2O/c1-15-7-12-20(21)22(13-15)14-19(23)18-10-8-17(9-11-18)16-5-3-2-4-6-16/h2-13,21H,14H2,1H3
InChIKey VBWCEEOIRKAURW-UHFFFAOYSA-N
Mol Weight 302.38 g/mol
Molecular Formula C20H18N2O
Exact Mass 302.141913 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GDqEnOgmTSZ
Name 2(1H)-Imino-5-methyl-1-(4'-phenylphenacyl)pyridine
Comments Computed using HOSE algorithm
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Exact Mass 302.141913207 u
Formula C20H18N2O
InChI InChI=1S/C20H18N2O/c1-15-7-12-20(21)22(13-15)14-19(23)18-10-8-17(9-11-18)16-5-3-2-4-6-16/h2-13,21H,14H2,1H3
InChIKey VBWCEEOIRKAURW-UHFFFAOYSA-N
Molecular Weight 302.377 g/mol
SMILES N=C1C=CC(=CN1CC(=O)c1ccc(cc1)-c1ccccc1)C