| SpectraBase Spectrum ID |
6UR5ITHzdlF |
| Name |
1-Benzyl-1H-[1,2,4]triazol-4-iumbenzoyl-2,4,6-triniyrophenylmethylide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H16N6O7 |
| InChI |
InChI=1S/C23H16N6O7/c30-23(17-9-5-2-6-10-17)22(25-14-24-26(15-25)13-16-7-3-1-4-8-16)21-19(28(33)34)11-18(27(31)32)12-20(21)29(35)36/h1-12,14-15H,13H2 |
| InChIKey |
ZPNUMZSLKJEMSP-UHFFFAOYSA-N |
| Molecular Weight |
488.416 g/mol |
| SMILES |
[C-]([n+]1c[n](Cc2ccccc2)nc1)(c1c(N(=O)=O)cc(N(=O)=O)cc1N(=O)=O)C(=O)c1ccccc1 |
| SPLASH |
splash10-0006-0000900000-f3963eb996da43840e8b |
| Source of Spectrum |
F-56-379-8 |
| Wiley ID |
855555 |
![1-Benzyl-1H-[1,2,4]triazol-4-iumbenzoyl-2,4,6-triniyrophenylmethylide](/api/spectrum/6UR5ITHzdlF/structure.png?h=300&w=458 "1-Benzyl-1H-[1,2,4]triazol-4-iumbenzoyl-2,4,6-triniyrophenylmethylide")
