| SpectraBase Spectrum ID |
8z9A0m8YnGI |
| Name |
2,4,5-Triphenyl-N-(phenylmethyl)-3H-1,2,4-triazol-3-amine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
404.200096789 u |
| Formula |
C27H24N4 |
| InChI |
InChI=1S/C27H24N4/c1-5-13-22(14-6-1)21-28-27-30(24-17-9-3-10-18-24)26(23-15-7-2-8-16-23)29-31(27)25-19-11-4-12-20-25/h1-20,27-28H,21H2 |
| InChIKey |
RHIOIPVHGWQWBD-UHFFFAOYSA-N |
| Molecular Weight |
404.517 g/mol |
| SMILES |
C1(=NN(C(N1C=1C=CC=CC1)NCC=1C=CC=CC1)C=1C=CC=CC1)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94162 |
