| SpectraBase Compound ID | BvMyq3sO0CO |
|---|---|
| InChI | InChI=1S/C10H11N5O2/c11-9-8-10(13-4-12-9)15(5-14-8)7-2-1-6(3-16)17-7/h1-2,4-7,16H,3H2,(H2,11,12,13) |
| InChIKey | JFUOUIPRAAGUGF-UHFFFAOYSA-N |
| Mol Weight | 233.23 g/mol |
| Molecular Formula | C10H11N5O2 |
| Exact Mass | 233.091275 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jd5rOMpGhFT |
|---|---|
| Name | Adenine, 9-(2,3-dideoxy-.beta.-D-glycero-pent-2-enofuranosyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 233.091274612 u |
| Formula | C10H11N5O2 |
| InChI | InChI=1S/C10H11N5O2/c11-9-8-10(13-4-12-9)15(5-14-8)7-2-1-6(3-16)17-7/h1-2,4-7,16H,3H2,(H2,11,12,13) |
| InChIKey | JFUOUIPRAAGUGF-UHFFFAOYSA-N |
| Molecular Weight | 233.231 g/mol |
| SMILES | C12=C(C(=NC=N2)N)N=CN1C1C=CC(CO)O1 |