SpectraBase Spectrum ID |
I5lgEV7EJO1 |
Name |
Piperazine, 1-(2-ethoxyphenyl)-4-(3,4-methylenedioxybenzyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
340.178692638 u |
Formula |
C20H24N2O3 |
InChI |
InChI=1S/C20H24N2O3/c1-2-23-18-6-4-3-5-17(18)22-11-9-21(10-12-22)14-16-7-8-19-20(13-16)25-15-24-19/h3-8,13H,2,9-12,14-15H2,1H3 |
InChIKey |
CAKAHMVANVFKFD-UHFFFAOYSA-N |
Molecular Weight |
340.423 g/mol |
SMILES |
C1CN(CCN1C1=CC=CC=C1OCC)CC=1C=C2OCOC2=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.929678 |