| SpectraBase Spectrum ID |
48GOFYydjN9 |
| Name |
[1,2,4]Triazolo[5,1-C][1,2,4]triazin-4(8H)-one, 3-methyl-7-(1-naphthalenylamino)-8-[(phenylmethylene)amino]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
395.149458194 u |
| Formula |
C22H17N7O |
| InChI |
InChI=1S/C22H17N7O/c1-15-20(30)28-22(26-25-15)29(23-14-16-8-3-2-4-9-16)21(27-28)24-19-13-7-11-17-10-5-6-12-18(17)19/h2-14H,1H3,(H,24,27)/b23-14+ |
| InChIKey |
MKZPQLPMPMFUHG-OEAKJJBVSA-N |
| Molecular Weight |
395.426 g/mol |
| SMILES |
C=12N(N=C(N2\N=C\C2=CC=CC=C2)NC2=C3C(C=CC=C3)=CC=C2)C(C(=NN1)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.876424 |