![5'-O-[3-[(TOL-4-YL)-SULFONYLOXY]-PROPYL]-ADENOSINE](/api/spectrum/1pWfZBf4X5l/structure.png?h=300&w=458 "5'-O-[3-[(TOL-4-YL)-SULFONYLOXY]-PROPYL]-ADENOSINE")
| SpectraBase Compound ID | ERz5nnCnk4G |
|---|---|
| InChI | InChI=1S/C20H25N5O7S/c1-12-3-5-13(6-4-12)33(28,29)31-8-2-7-30-9-14-16(26)17(27)20(32-14)25-11-24-15-18(21)22-10-23-19(15)25/h3-6,10-11,14,16-17,20,26-27H,2,7-9H2,1H3,(H2,21,22,23)/t14-,16-,17-,20-/m0/s1 |
| InChIKey | FMYPQZXZJACNEA-VERUCKTNSA-N |
| Mol Weight | 479.51 g/mol |
| Molecular Formula | C20H25N5O7S |
| Exact Mass | 479.147469 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1pWfZBf4X5l |
|---|---|
| Name | 5'-O-[3-[(TOL-4-YL)-SULFONYLOXY]-PROPYL]-ADENOSINE |
| Compound Number | 12A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H25N5O7S |
| InChI | InChI=1S/C20H25N5O7S/c1-12-3-5-13(6-4-12)33(28,29)31-8-2-7-30-9-14-16(26)17(27)20(32-14)25-11-24-15-18(21)22-10-23-19(15)25/h3-6,10-11,14,16-17,20,26-27H,2,7-9H2,1H3,(H2,21,22,23)/t14-,16-,17-,20-/m0/s1 |
| InChIKey | FMYPQZXZJACNEA-VERUCKTNSA-N |
| Literature Reference Author | L.POPPE,W.E.HULL,J.RETEY |
| Literature Reference Citation | HELV.CHIM.ACTA,76,2367(1993) |
| Literature Reference DOI | 10.1002/hlca.19930760623 |
| Molecular Weight | 479.508 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSK30 |