![1-[3'-DEOXY-5'-O-(4,4'-DIMETHOXYTRITYL)-THYMIDIN-3'-YL]-4-(5'-DEOXY-THYMIDIN-5'-YL)-1H-1,2,3-TRIAZOLE](/api/spectrum/9Zwr1isYjzE/structure.png?h=300&w=458 "1-[3'-DEOXY-5'-O-(4,4'-DIMETHOXYTRITYL)-THYMIDIN-3'-YL]-4-(5'-DEOXY-THYMIDIN-5'-YL)-1H-1,2,3-TRIAZOLE")
| SpectraBase Compound ID | 5hdWJDjGCwe |
|---|---|
| InChI | InChI=1S/C43H45N7O10/c1-25-21-48(41(54)44-39(25)52)37-19-33(50-23-30(46-47-50)18-35-34(51)20-38(59-35)49-22-26(2)40(53)45-42(49)55)36(60-37)24-58-43(27-8-6-5-7-9-27,28-10-14-31(56-3)15-11-28)29-12-16-32(57-4)17-13-29/h5-17,21-23,33-38,51H,18-20,24H2,1-4H3,(H,44,52,54)(H,45,53,55)/t33-,34+,35-,36+,37+,38-/m0/s1 |
| InChIKey | FYUAWWADPZXDOS-ZHWFMFJDSA-N |
| Mol Weight | 819.9 g/mol |
| Molecular Formula | C43H45N7O10 |
| Exact Mass | 819.322791 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Zwr1isYjzE |
|---|---|
| Name | 1-[3'-DEOXY-5'-O-(4,4'-DIMETHOXYTRITYL)-THYMIDIN-3'-YL]-4-(5'-DEOXY-THYMIDIN-5'-YL)-1H-1,2,3-TRIAZOLE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H45N7O10 |
| InChI | InChI=1S/C43H45N7O10/c1-25-21-48(41(54)44-39(25)52)37-19-33(50-23-30(46-47-50)18-35-34(51)20-38(59-35)49-22-26(2)40(53)45-42(49)55)36(60-37)24-58-43(27-8-6-5-7-9-27,28-10-14-31(56-3)15-11-28)29-12-16-32(57-4)17-13-29/h5-17,21-23,33-38,51H,18-20,24H2,1-4H3,(H,44,52,54)(H,45,53,55)/t33-,34+,35-,36+,37+,38-/m0/s1 |
| InChIKey | FYUAWWADPZXDOS-ZHWFMFJDSA-N |
| Literature Reference Author | A.VARIZHUK,A.CHIZHOV,I.SMIRNOV,D.KALUZHNY,V.FLORENTIEV |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2012,2173(2012) |
| Literature Reference DOI | 10.1002/ejoc.201101700 |
| Molecular Weight | 819.871 g/mol |
| Solvent | DMSO |
| Source File Reference | UWLU84618 |