| SpectraBase Spectrum ID |
3giDWwWnpHq |
| Name |
3-Benzyl-6-methyl-4-propan-2-on-2,6-dioxo-4,5,6,7-tetrahydro-1,2,3-triazolo[4,5-D]pyrimidine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
313.117489360 u |
| Formula |
C15H15N5O3 |
| InChI |
InChI=1S/C15H15N5O3/c1-10(21)8-19-13-12(14(22)18(2)15(19)23)16-17-20(13)9-11-6-4-3-5-7-11/h3-7H,8-9H2,1-2H3 |
| InChIKey |
BODVCRUDMDXCSF-UHFFFAOYSA-N |
| Molecular Weight |
313.317 g/mol |
| SMILES |
CN1C(=O)N(C2=C(C1=O)N=NN2CC1=CC=CC=C1)CC(=O)C |
![3-Benzyl-6-methyl-4-propan-2-on-2,6-dioxo-4,5,6,7-tetrahydro-1,2,3-triazolo[4,5-D]pyrimidine](/api/spectrum/3giDWwWnpHq/structure.png?h=300&w=458 "3-Benzyl-6-methyl-4-propan-2-on-2,6-dioxo-4,5,6,7-tetrahydro-1,2,3-triazolo[4,5-D]pyrimidine")
