| SpectraBase Compound ID | ADWqJWc6Rfr |
|---|---|
| InChI | InChI=1S/2C18H22N5O6P/c2*1-5-7-25-30(24,6-2)26-8-11-13-14(29-18(3,4)28-13)17(27-11)23-10-22-12-15(19)20-9-21-16(12)23/h2*2,5,9-11,13-14,17H,1,7-8H2,3-4H3,(H2,19,20,21)/t2*11-,13-,14-,17-,30?/m10/s1 |
| InChIKey | UNUWAJMKDGNKGF-IYCWYSDNSA-N |
| Mol Weight | 870.75 g/mol |
| Molecular Formula | C36H44N10O12P2 |
| Exact Mass | 870.261541 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FdsdZ6ZoaaG |
|---|---|
| Name | ACETYLENE-BETA-(2',3'-O,O-ISOPROPYLIDENE)-5'-O-(ALLYL-ETHYNEPHOSPHONYL)-D-ADENOSINE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H44N10O12P2 |
| InChI | InChI=1S/2C18H22N5O6P/c2*1-5-7-25-30(24,6-2)26-8-11-13-14(29-18(3,4)28-13)17(27-11)23-10-22-12-15(19)20-9-21-16(12)23/h2*2,5,9-11,13-14,17H,1,7-8H2,3-4H3,(H2,19,20,21)/t2*11-,13-,14-,17-,30?/m10/s1 |
| InChIKey | UNUWAJMKDGNKGF-IYCWYSDNSA-N |
| Literature Reference Author | K.V.DERPOORTEN,M.E.MIGAUD |
| Literature Reference Citation | ORG.LETTERS,6,3461(2004) |
| Literature Reference DOI | 10.1021/ol0488993 |
| Molecular Weight | 870.753 g/mol |
| Sample ID | 33355 |
| Solvent | CDCl3 |