![1-[3-C-ALLYL-5-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-RIBOFURANOSYL]-THYMINE](/api/spectrum/GddE4n5EUz7/structure.png?h=300&w=458 "1-[3-C-ALLYL-5-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-RIBOFURANOSYL]-THYMINE")
| SpectraBase Compound ID | 5QprxYYpPM2 |
|---|---|
| InChI | InChI=1S/C34H36N2O8/c1-5-19-33(40)28(44-31(29(33)37)36-20-22(2)30(38)35-32(36)39)21-43-34(23-9-7-6-8-10-23,24-11-15-26(41-3)16-12-24)25-13-17-27(42-4)18-14-25/h5-18,20,28-29,31,37,40H,1,19,21H2,2-4H3,(H,35,38,39)/t28-,29+,31-,33-/m1/s1 |
| InChIKey | WXEQSTUIXZWDKP-RCANGYALSA-N |
| Mol Weight | 600.7 g/mol |
| Molecular Formula | C34H36N2O8 |
| Exact Mass | 600.247166 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GddE4n5EUz7 |
|---|---|
| Name | 1-[3-C-ALLYL-5-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-RIBOFURANOSYL]-THYMINE |
| Compound Number | 18 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H36N2O8 |
| InChI | InChI=1S/C34H36N2O8/c1-5-19-33(40)28(44-31(29(33)37)36-20-22(2)30(38)35-32(36)39)21-43-34(23-9-7-6-8-10-23,24-11-15-26(41-3)16-12-24)25-13-17-27(42-4)18-14-25/h5-18,20,28-29,31,37,40H,1,19,21H2,2-4H3,(H,35,38,39)/t28-,29+,31-,33-/m1/s1 |
| InChIKey | WXEQSTUIXZWDKP-RCANGYALSA-N |
| Literature Reference Author | P.N.JORGENSEN,U.S.SORENSEN,H.M.PFUNDHELLER,C.E.OLSEN,J.WENGE L |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,3275(1997) |
| Literature Reference DOI | 10.1039/a703173d |
| Molecular Weight | 600.668 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU7216 |