| SpectraBase Compound ID | 9ElWbeTV1jn |
|---|---|
| InChI | InChI=1S/C12H17N3O5/c1-6-5-15(12(18)14-11(6)17)10-3-8(19-7(2)16)9(4-13)20-10/h5,8-10H,3-4,13H2,1-2H3,(H,14,17,18) |
| InChIKey | KIDWNDSBSZGYKG-UHFFFAOYSA-N |
| Mol Weight | 283.28 g/mol |
| Molecular Formula | C12H17N3O5 |
| Exact Mass | 283.116821 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4GVf8GGr0kj |
|---|---|
| Name | Thymidine, 5'-amino-5'-deoxy-, 3'-acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.116820654 u |
| Formula | C12H17N3O5 |
| InChI | InChI=1S/C12H17N3O5/c1-6-5-15(12(18)14-11(6)17)10-3-8(19-7(2)16)9(4-13)20-10/h5,8-10H,3-4,13H2,1-2H3,(H,14,17,18) |
| InChIKey | KIDWNDSBSZGYKG-UHFFFAOYSA-N |
| SMILES | C1(=O)N(C2CC(OC(C)=O)C(O2)CN)C=C(C(N1)=O)C |