| SpectraBase Spectrum ID |
LjaAO6n73xr |
| Name |
1-Acetonyl-3,7-dimethyl-9H-purine-2,6,8-trione |
| Alternate Name(s) |
3,7-Dimethyl-1-(2-oxidanylidenepropyl)-9H-purine-2,6,8-trione
3,7-Dimethyl-1-(2-oxopropyl)-9H-purine-2,6,8-trione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H12N4O4 |
| InChI |
InChI=1S/C10H12N4O4/c1-5(15)4-14-8(16)6-7(13(3)10(14)18)11-9(17)12(6)2/h4H2,1-3H3,(H,11,17) |
| InChIKey |
IYHHQKILCVBBHP-UHFFFAOYSA-N |
| Molecular Weight |
252.230 g/mol |
| SMILES |
N1C(N(C2=C1N(C(N(C2=O)CC(=O)C)=O)C)C)=O |
| SPLASH |
splash10-0zfs-0490000000-072c43c461f1e093b0e0 |
| Source of Spectrum |
KC-0-679-32 |
| Wiley ID |
827718 |
