SpectraBase Spectrum ID |
JCnfBgpuFK3 |
Name |
1-(1-(3-Methoxyphenyl)propan-2-yl)piperazine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
234.173213335 u |
Formula |
C14H22N2O |
InChI |
InChI=1S/C14H22N2O/c1-12(16-8-6-15-7-9-16)10-13-4-3-5-14(11-13)17-2/h3-5,11-12,15H,6-10H2,1-2H3 |
InChIKey |
RAKQEOWMZMYSPT-UHFFFAOYSA-N |
Molecular Weight |
234.343 g/mol |
SMILES |
C1(=CC=CC(=C1)CC(N1CCNCC1)C)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.870106 |