| SpectraBase Compound ID | EVY95xFDgnO |
|---|---|
| InChI | InChI=1S/C19H36N4O4SSi3/c1-29(2,3)24-10-13-15(26-30(4,5)6)16(27-31(7,8)9)19(25-13)23-12-22-14-17(23)20-11-21-18(14)28/h11-13,15-16,19H,10H2,1-9H3,(H,20,21,28)/t13-,15-,16-,19-/m1/s1 |
| InChIKey | DWCVWOZAAVTDAB-NVQRDWNXSA-N |
| Mol Weight | 500.8 g/mol |
| Molecular Formula | C19H36N4O4SSi3 |
| Exact Mass | 500.176506 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2bpjLO2UoHz |
|---|---|
| Name | Thioinosine, 3tms derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 500.176506430 u |
| Formula | C19H36N4O4SSi3 |
| InChI | InChI=1S/C19H36N4O4SSi3/c1-29(2,3)24-10-13-15(26-30(4,5)6)16(27-31(7,8)9)19(25-13)23-12-22-14-17(23)20-11-21-18(14)28/h11-13,15-16,19H,10H2,1-9H3,(H,20,21,28)/t13-,15-,16-,19-/m1/s1 |
| InChIKey | DWCVWOZAAVTDAB-NVQRDWNXSA-N |
| Molecular Weight | 500.836 g/mol |
| SMILES | C1(S)=NC=NC2=C1N=CN2[C@]1([H])O[C@@]([H])([C@@]([C@@]1([H])O[Si](C)(C)C)([H])O[Si](C)(C)C)CO[Si](C)(C)C |