| SpectraBase Compound ID | 2ppH4SaEdd0 |
|---|---|
| InChI | InChI=1S/C11H17N5O2/c1-13(2)5-6-16-7-12-9-8(16)10(17)15(4)11(18)14(9)3/h7H,5-6H2,1-4H3 |
| InChIKey | CMKUGKVVUUGBHJ-UHFFFAOYSA-N |
| Mol Weight | 251.29 g/mol |
| Molecular Formula | C11H17N5O2 |
| Exact Mass | 251.138225 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AlW0wvRtUDZ |
|---|---|
| Name | 3,7-Dihydropurine-2,6-dione, 7-(2-dimethylaminoethyl)-1,3-dimethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.138224805 u |
| Formula | C11H17N5O2 |
| InChI | InChI=1S/C11H17N5O2/c1-13(2)5-6-16-7-12-9-8(16)10(17)15(4)11(18)14(9)3/h7H,5-6H2,1-4H3 |
| InChIKey | CMKUGKVVUUGBHJ-UHFFFAOYSA-N |
| Molecular Weight | 251.290 g/mol |
| SMILES | C12=C(C(=O)N(C(N2C)=O)C)N(CCN(C)C)C=N1 |