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1-(p-Chlorobenzyl)-1,6-dihydro-N-methyl-6-oxonicotinanilide

View entire compound with spectra: 2 NMR, and 1 FTIR

1-(p-Chlorobenzyl)-1,6-dihydro-N-methyl-6-oxonicotinanilide
SpectraBase Compound ID 4OAL9OiAftl
InChI InChI=1S/C20H17ClN2O2/c1-22(18-5-3-2-4-6-18)20(25)16-9-12-19(24)23(14-16)13-15-7-10-17(21)11-8-15/h2-12,14H,13H2,1H3
InChIKey RCNMKEBJGWSETF-UHFFFAOYSA-N
Mol Weight 352.82 g/mol
Molecular Formula C20H17ClN2O2
Exact Mass 352.097855 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 54yNa0BST54
Name 1-(p-Chlorobenzyl)-1,6-dihydro-N-methyl-6-oxonicotinanilide
Comments Computed using HOSE algorithm
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Exact Mass 352.097855493 u
Formula C20H17ClN2O2
InChI InChI=1S/C20H17ClN2O2/c1-22(18-5-3-2-4-6-18)20(25)16-9-12-19(24)23(14-16)13-15-7-10-17(21)11-8-15/h2-12,14H,13H2,1H3
InChIKey RCNMKEBJGWSETF-UHFFFAOYSA-N
Molecular Weight 352.821 g/mol
SMILES CN(C(C=1C=CC(N(C1)CC1=CC=C(C=C1)Cl)=O)=O)C1=CC=CC=C1