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1-Benzyl-N-butyl-N-(2-methylphenyl)piperidin-4-amine

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

1-Benzyl-N-butyl-N-(2-methylphenyl)piperidin-4-amine
SpectraBase Compound ID 7ciWdFJxQ75
InChI InChI=1S/C23H32N2/c1-3-4-16-25(23-13-9-8-10-20(23)2)22-14-17-24(18-15-22)19-21-11-6-5-7-12-21/h5-13,22H,3-4,14-19H2,1-2H3
InChIKey MAQJNBXDWIOXEA-UHFFFAOYSA-N
Mol Weight 336.5 g/mol
Molecular Formula C23H32N2
Exact Mass 336.256549 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FWNfCbiWKJ
Name 1-Benzyl-N-butyl-N-(2-methylphenyl)piperidin-4-amine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 336.256549038 u
Formula C23H32N2
InChI InChI=1S/C23H32N2/c1-3-4-16-25(23-13-9-8-10-20(23)2)22-14-17-24(18-15-22)19-21-11-6-5-7-12-21/h5-13,22H,3-4,14-19H2,1-2H3
InChIKey MAQJNBXDWIOXEA-UHFFFAOYSA-N
Molecular Weight 336.523 g/mol
SMILES C=1(N(C2CCN(CC=3C=CC=CC3)CC2)CCCC)C(=CC=CC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.853731