| SpectraBase Compound ID | 5ZN0ldzOdNY |
|---|---|
| InChI | InChI=1S/C8H11N5O/c1-5(14)2-13-4-12-6-7(9)10-3-11-8(6)13/h3-5,14H,2H2,1H3,(H2,9,10,11)/t5-/m1/s1 |
| InChIKey | MJZYTEBKXLVLMY-RXMQYKEDSA-N |
| Mol Weight | 193.21 g/mol |
| Molecular Formula | C8H11N5O |
| Exact Mass | 193.09636 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 80YpaZ4zvj1 |
|---|---|
| Name | (2R)-1-(6-Amino-9H-purin-9-yl)-2-propanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 193.096359993 u |
| Formula | C8H11N5O |
| InChI | InChI=1S/C8H11N5O/c1-5(14)2-13-4-12-6-7(9)10-3-11-8(6)13/h3-5,14H,2H2,1H3,(H2,9,10,11)/t5-/m1/s1 |
| InChIKey | MJZYTEBKXLVLMY-RXMQYKEDSA-N |
| Molecular Weight | 193.210 g/mol |
| SMILES | [C@@](CN1C2=C(C(N)=NC=N2)N=C1)(C)(O)[H] |