| SpectraBase Compound ID | nPuaiHsgTC |
|---|---|
| InChI | InChI=1S/2C34H36N3O9P/c2*1-23-21-37(33(39)36-32(23)38)31-20-29(46-47(40)44-19-7-18-35)30(45-31)22-43-34(24-8-5-4-6-9-24,25-10-14-27(41-2)15-11-25)26-12-16-28(42-3)17-13-26/h2*4-6,8-17,21,29-31,47H,7,19-20,22H2,1-3H3,(H,36,38,39)/t2*29-,30+,31+/m00/s1 |
| InChIKey | FGTZEYHEPWTMDA-LTHCDSNASA-N |
| Mol Weight | 1323.3 g/mol |
| Molecular Formula | C68H72N6O18P2 |
| Exact Mass | 1322.437833 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B8T1ltFNixW |
|---|---|
| Name | CYANOETHYL-5'-O-(4,4'-DIMETHOXYTRITYL)-THYMIDINE-3'-YL-PHOSPHONATE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C68H70N6O18P2 |
| InChI | InChI=1S/2C34H36N3O9P/c2*1-23-21-37(33(39)36-32(23)38)31-20-29(46-47(40)44-19-7-18-35)30(45-31)22-43-34(24-8-5-4-6-9-24,25-10-14-27(41-2)15-11-25)26-12-16-28(42-3)17-13-26/h2*4-6,8-17,21,29-31,47H,7,19-20,22H2,1-3H3,(H,36,38,39)/t2*29-,30+,31+/m00/s1 |
| InChIKey | FGTZEYHEPWTMDA-LTHCDSNASA-N |
| Literature Reference Author | M.SEKINE,A.OHKUBO,K.SEIO |
| Literature Reference Citation | J.ORG.CHEM.,68,5478(2003) |
| Literature Reference DOI | 10.1021/jo034204k |
| Molecular Weight | 1321.281 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN25335 |