| SpectraBase Spectrum ID |
DIsVYt3Ov6I |
| Name |
8-(Acetylamino0-3,6-dimethyl-1,5,6,7-tetrahydro-(sym)-triazolo[4,3-C]pyrimidine-5,7-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
237.086189231 u |
| Formula |
C9H11N5O3 |
| InChI |
InChI=1S/C9H11N5O3/c1-4-11-12-7-6(10-5(2)15)8(16)13(3)9(17)14(4)7/h12H,1-3H3,(H,10,15) |
| InChIKey |
LQRRWTNHPOGNNI-UHFFFAOYSA-N |
| Molecular Weight |
237.219 g/mol |
| SMILES |
C1=2N(C(=O)N(C(C2NC(=O)C)=O)C)C(C)=NN1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.973201 |
![8-(Acetylamino0-3,6-dimethyl-1,5,6,7-tetrahydro-(sym)-triazolo[4,3-c]pyrimidine-5,7-dione](/api/spectrum/DIsVYt3Ov6I/structure.png?h=300&w=458 "8-(Acetylamino0-3,6-dimethyl-1,5,6,7-tetrahydro-(sym)-triazolo[4,3-c]pyrimidine-5,7-dione")
