| SpectraBase Spectrum ID |
FRdjsBrqee9 |
| Name |
1-(3-Trifluoromethylbenzyl)-4-phenylpiperazine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
320.150033109 u |
| Formula |
C18H19F3N2 |
| InChI |
InChI=1S/C18H19F3N2/c19-18(20,21)16-6-4-5-15(13-16)14-22-9-11-23(12-10-22)17-7-2-1-3-8-17/h1-8,13H,9-12,14H2 |
| InChIKey |
WZOKPLZWQAWTGI-UHFFFAOYSA-N |
| Molecular Weight |
320.359 g/mol |
| SMILES |
C1(C(F)(F)F)=CC(CN2CCN(C3=CC=CC=C3)CC2)=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918394 |
