| SpectraBase Compound ID | 6uZFgtm7Wuc |
|---|---|
| InChI | InChI=1S/C11H14N4O4/c1-7(16)19-5-4-15-6-12-9-8(15)10(17)14(3)11(18)13(9)2/h6H,4-5H2,1-3H3 |
| InChIKey | CQKZJBMFMGGBHJ-UHFFFAOYSA-N |
| Mol Weight | 266.26 g/mol |
| Molecular Formula | C11H14N4O4 |
| Exact Mass | 266.101505 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GKtrIYO0Xeb |
|---|---|
| Name | 1H-Purine-2,6-dione, 7-[2-(acetyloxy)ethyl]-3,7-dihydro-1,3-dimethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 266.101504943 u |
| Formula | C11H14N4O4 |
| InChI | InChI=1S/C11H14N4O4/c1-7(16)19-5-4-15-6-12-9-8(15)10(17)14(3)11(18)13(9)2/h6H,4-5H2,1-3H3 |
| InChIKey | CQKZJBMFMGGBHJ-UHFFFAOYSA-N |
| Molecular Weight | 266.257 g/mol |
| SMILES | C1(N(C(N(C=2N=CN(C12)CCOC(=O)C)C)=O)C)=O |