N-4-Methylphenyl-N-[1-(1-phenylpropan-2-yl)piperidin-4-yl]-3-methoxybenzamide

SpectraBase Compound ID	Bwpsea4QzYP
InChI	InChI=1S/C29H34N2O2/c1-22-12-14-26(15-13-22)31(29(32)25-10-7-11-28(21-25)33-3)27-16-18-30(19-17-27)23(2)20-24-8-5-4-6-9-24/h4-15,21,23,27H,16-20H2,1-3H3
InChIKey	BSSZHDLRUJLGDF-UHFFFAOYSA-N Google Search
Mol Weight	442.6 g/mol
Molecular Formula	C29H34N2O2
Exact Mass	442.262028 g/mol

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SpectraBase Spectrum ID	LWq0ZunHKK8
Name	N-4-Methylphenyl-N-[1-(1-phenylpropan-2-yl)piperidin-4-yl]-3-methoxybenzamide
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	442.262028341 u
Formula	C29H34N2O2
InChI	InChI=1S/C29H34N2O2/c1-22-12-14-26(15-13-22)31(29(32)25-10-7-11-28(21-25)33-3)27-16-18-30(19-17-27)23(2)20-24-8-5-4-6-9-24/h4-15,21,23,27H,16-20H2,1-3H3
InChIKey	BSSZHDLRUJLGDF-UHFFFAOYSA-N
Molecular Weight	442.603 g/mol
SMILES	C(N(C1CCN(C(CC=2C=CC=CC2)C)CC1)C=1C=CC(=CC1)C)(C=1C=C(C=CC1)OC)=O
Spectrum/Structure Validation Score (Vapor Phase IR)	0.872409