| SpectraBase Spectrum ID |
1qs00FcVLHT |
| Name |
[1,2,4]Triazolo[5,1-C][1,2,4]triazin-4(8H)-one, 3-methyl-7-(2-naphthalenyl)-8-[(phenylmethylene)amino]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
380.138559158 u |
| Formula |
C22H16N6O |
| InChI |
InChI=1S/C22H16N6O/c1-15-21(29)28-22(25-24-15)27(23-14-16-7-3-2-4-8-16)20(26-28)19-12-11-17-9-5-6-10-18(17)13-19/h2-14H,1H3/b23-14+ |
| InChIKey |
VWQKFUSEPQLAGS-OEAKJJBVSA-N |
| Molecular Weight |
380.411 g/mol |
| SMILES |
C=12N(N=C(N2\N=C\C=2C=CC=CC2)C=2C=C3C=CC=CC3=CC2)C(C(=NN1)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.905466 |