| SpectraBase Spectrum ID |
A8PlDLOn2qo |
| Name |
4-Phenethyl-N-(1-phenylethyl)aniline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
301.183049745 u |
| Formula |
C22H23N |
| InChI |
InChI=1S/C22H23N/c1-18(21-10-6-3-7-11-21)23-22-16-14-20(15-17-22)13-12-19-8-4-2-5-9-19/h2-11,14-18,23H,12-13H2,1H3 |
| InChIKey |
ZKDGAXKBKWHAKE-UHFFFAOYSA-N |
| SMILES |
C(NC=1C=CC(=CC1)CCC1=CC=CC=C1)(C)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.90162 |