| SpectraBase Compound ID | 4iwsDqI6Z1R |
|---|---|
| InChI | InChI=1S/C9H11N5O/c10-8-7-9(12-4-11-8)14(5-13-7)6-2-1-3-15-6/h4-6H,1-3H2,(H2,10,11,12) |
| InChIKey | UKHMZCMKHPHFOT-UHFFFAOYSA-N |
| Mol Weight | 205.22 g/mol |
| Molecular Formula | C9H11N5O |
| Exact Mass | 205.09636 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bd2qNnMLKVZ |
|---|---|
| Name | 9H-Purin-6-amine, 9-(tetrahydro-2-furanyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 205.096359993 u |
| Formula | C9H11N5O |
| InChI | InChI=1S/C9H11N5O/c10-8-7-9(12-4-11-8)14(5-13-7)6-2-1-3-15-6/h4-6H,1-3H2,(H2,10,11,12) |
| InChIKey | UKHMZCMKHPHFOT-UHFFFAOYSA-N |
| Molecular Weight | 205.221 g/mol |
| SMILES | C1(N)=C2C(N(C3CCCO3)C=N2)=NC=N1 |