![1-[5'-O-(4,4'-DIMETHOXYTRITYL)-2'-O-(2-TRIFLUOROACETAMIDO)-ETHYL-BETA-D-RIBOFURANOSYL]-5-METHYL-2-PYRIMIDINONE](/api/spectrum/9TwO8DzKP83/structure.png?h=300&w=458 "1-[5'-O-(4,4'-DIMETHOXYTRITYL)-2'-O-(2-TRIFLUOROACETAMIDO)-ETHYL-BETA-D-RIBOFURANOSYL]-5-METHYL-2-PYRIMIDINONE")
| SpectraBase Compound ID | 9WDDa6g5bBS |
|---|---|
| InChI | InChI=1S/C35H36F3N3O8/c1-22-19-40-33(44)41(20-22)31-30(47-18-17-39-32(43)35(36,37)38)29(42)28(49-31)21-48-34(23-7-5-4-6-8-23,24-9-13-26(45-2)14-10-24)25-11-15-27(46-3)16-12-25/h4-16,19-20,28-31,42H,17-18,21H2,1-3H3,(H,39,43)/t28-,29-,30-,31-/m0/s1 |
| InChIKey | XDXCRUGSJSKETN-ORYMTKCHSA-N |
| Mol Weight | 683.7 g/mol |
| Molecular Formula | C35H36F3N3O8 |
| Exact Mass | 683.24545 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9TwO8DzKP83 |
|---|---|
| Name | 1-[5'-O-(4,4'-DIMETHOXYTRITYL)-2'-O-(2-TRIFLUOROACETAMIDO)-ETHYL-BETA-D-RIBOFURANOSYL]-5-METHYL-2-PYRIMIDINONE |
| Compound Number | 24 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H36F3N3O8 |
| InChI | InChI=1S/C35H36F3N3O8/c1-22-19-40-33(44)41(20-22)31-30(47-18-17-39-32(43)35(36,37)38)29(42)28(49-31)21-48-34(23-7-5-4-6-8-23,24-9-13-26(45-2)14-10-24)25-11-15-27(46-3)16-12-25/h4-16,19-20,28-31,42H,17-18,21H2,1-3H3,(H,39,43)/t28-,29-,30-,31-/m0/s1 |
| InChIKey | XDXCRUGSJSKETN-ORYMTKCHSA-N |
| Literature Reference Author | S.BUCHINI,C.J.LEUMANN |
| Literature Reference Citation | EUR.J.ORG.CHEM.,3152(2006) |
| Molecular Weight | 683.681 g/mol |
| Sample ID | 44134 |
| Solvent | CDCl3 |