| SpectraBase Compound ID | gVZsDqHvml |
|---|---|
| InChI | InChI=1S/C10H15N5O4/c11-9-8-10(13-4-12-9)15(5-14-8)7(3-18)19-6(1-16)2-17/h4-7,16-18H,1-3H2,(H2,11,12,13) |
| InChIKey | BZOVHPRDLVWHRY-UHFFFAOYSA-N |
| Mol Weight | 269.26 g/mol |
| Molecular Formula | C10H15N5O4 |
| Exact Mass | 269.112404 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2makA0AGzLY |
|---|---|
| Name | 2-(1-Adenin-9-yl-2-hydroxy-ethoxy)propane-1,3-diol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.112403979 u |
| Formula | C10H15N5O4 |
| InChI | InChI=1S/C10H15N5O4/c11-9-8-10(13-4-12-9)15(5-14-8)7(3-18)19-6(1-16)2-17/h4-7,16-18H,1-3H2,(H2,11,12,13) |
| InChIKey | BZOVHPRDLVWHRY-UHFFFAOYSA-N |
| SMILES | C(O)C(OC(N1C2=C(C(N)=NC=N2)N=C1)CO)CO |