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(4-Benzyl-piperidin-1-yl)-m-tolyl-methanone

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(4-Benzyl-piperidin-1-yl)-m-tolyl-methanone
SpectraBase Compound ID CE6gFgL725z
InChI InChI=1S/C20H23NO/c1-16-6-5-9-19(14-16)20(22)21-12-10-18(11-13-21)15-17-7-3-2-4-8-17/h2-9,14,18H,10-13,15H2,1H3
InChIKey POFAJEKTXKRKHK-UHFFFAOYSA-N
Mol Weight 293.41 g/mol
Molecular Formula C20H23NO
Exact Mass 293.177964 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CGsHh9azHFw
Name (4-Benzyl-piperidin-1-yl)-m-tolyl-methanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 293.177964364 u
Formula C20H23NO
InChI InChI=1S/C20H23NO/c1-16-6-5-9-19(14-16)20(22)21-12-10-18(11-13-21)15-17-7-3-2-4-8-17/h2-9,14,18H,10-13,15H2,1H3
InChIKey POFAJEKTXKRKHK-UHFFFAOYSA-N
SMILES C1=C(CC2CCN(CC2)C(=O)C2=CC=CC(C)=C2)C=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.803039