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4-Methyl-N-(1-phenylmethylpiperidin-4-yl)-N-(2-methylphenyl)benzamide
SpectraBase Compound ID LrXMkQT91ks
InChI InChI=1S/C27H30N2O/c1-21-12-14-24(15-13-21)27(30)29(26-11-7-6-8-22(26)2)25-16-18-28(19-17-25)20-23-9-4-3-5-10-23/h3-15,25H,16-20H2,1-2H3
InChIKey CBIZKTFGCKLREA-UHFFFAOYSA-N
Mol Weight 398.55 g/mol
Molecular Formula C27H30N2O
Exact Mass 398.235814 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9lZLFGifqJH
Name 4-Methyl-N-(1-phenylmethylpiperidin-4-yl)-N-(2-methylphenyl)benzamide
Comments Computed using HOSE algorithm
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Exact Mass 398.235813593 u
Formula C27H30N2O
InChI InChI=1S/C27H30N2O/c1-21-12-14-24(15-13-21)27(30)29(26-11-7-6-8-22(26)2)25-16-18-28(19-17-25)20-23-9-4-3-5-10-23/h3-15,25H,16-20H2,1-2H3
InChIKey CBIZKTFGCKLREA-UHFFFAOYSA-N
Molecular Weight 398.550 g/mol
SMILES C=1(N(C(C2=CC=C(C=C2)C)=O)C2CCN(CC2)CC=2C=CC=CC2)C(=CC=CC1)C