SpectraBase Spectrum ID |
KKj3pCQWG09 |
Name |
2-(4-Benzyl-piperazino)-1-phenylethanol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
296.188863400 u |
Formula |
C19H24N2O |
InChI |
InChI=1S/C19H24N2O/c22-19(18-9-5-2-6-10-18)16-21-13-11-20(12-14-21)15-17-7-3-1-4-8-17/h1-10,19,22H,11-16H2 |
InChIKey |
OMKPBKIXBACXLH-UHFFFAOYSA-N |
SMILES |
C(C1=CC=CC=C1)(O)CN1CCN(CC1)CC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.858316 |