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1-Benzyl-4-(2-(N-benzyl,N-methylamino)ethyl)piperazine
SpectraBase Compound ID L74PecpveC0
InChI InChI=1S/C21H29N3/c1-22(18-20-8-4-2-5-9-20)12-13-23-14-16-24(17-15-23)19-21-10-6-3-7-11-21/h2-11H,12-19H2,1H3
InChIKey LKICAZZNPLHDBW-UHFFFAOYSA-N
Mol Weight 323.48 g/mol
Molecular Formula C21H29N3
Exact Mass 323.236148 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DUFouAUrTaD
Name 1-Benzyl-4-(2-(N-benzyl,N-methylamino)ethyl)piperazine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 323.236147946 u
Formula C21H29N3
InChI InChI=1S/C21H29N3/c1-22(18-20-8-4-2-5-9-20)12-13-23-14-16-24(17-15-23)19-21-10-6-3-7-11-21/h2-11H,12-19H2,1H3
InChIKey LKICAZZNPLHDBW-UHFFFAOYSA-N
Molecular Weight 323.484 g/mol
SMILES C(N1CCN(CC1)CCN(CC1=CC=CC=C1)C)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.977345