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 |