| SpectraBase Spectrum ID |
LQwhNI2i7X3 |
| Name |
1,3-Dianilino-1-phenylpropane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
302.178298716 u |
| Formula |
C21H22N2 |
| InChI |
InChI=1S/C21H22N2/c1-4-10-18(11-5-1)21(23-20-14-8-3-9-15-20)16-17-22-19-12-6-2-7-13-19/h1-15,21-23H,16-17H2 |
| InChIKey |
ZRBWRLGHFRKQHC-UHFFFAOYSA-N |
| SMILES |
C(NC=1C=CC=CC1)(C=1C=CC=CC1)CCNC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.8659 |