| SpectraBase Compound ID | BrPs1lkKA0L |
|---|---|
| InChI | InChI=1S/C28H40N4O17P2/c1-7-41-50(39,43-13-21-19(45-17(5)33)9-23(47-21)31-11-15(3)25(35)29-27(31)37)49-51(40,42-8-2)44-14-22-20(46-18(6)34)10-24(48-22)32-12-16(4)26(36)30-28(32)38/h11-12,19-24H,7-10,13-14H2,1-6H3,(H,29,35,37)(H,30,36,38)/t19-,20-,21+,22+,23+,24+,50?,51?/m0/s1 |
| InChIKey | GHWJHLQKPZOTJY-ASDGOFDESA-N |
| Mol Weight | 766.6 g/mol |
| Molecular Formula | C28H40N4O17P2 |
| Exact Mass | 766.18637 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CpqEf914FWC |
|---|---|
| Name | P,P'-DIETHYL-P,P'-BIS(3'-O-ACETYLDEOXYTHYMIDIN-5'-YL)PYROPHOSPHATE |
| Comments | , SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED (S.T.) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C28H40N4O17P2 |
| InChI | InChI=1S/C28H40N4O17P2/c1-7-41-50(39,43-13-21-19(45-17(5)33)9-23(47-21)31-11-15(3)25(35)29-27(31)37)49-51(40,42-8-2)44-14-22-20(46-18(6)34)10-24(48-22)32-12-16(4)26(36)30-28(32)38/h11-12,19-24H,7-10,13-14H2,1-6H3,(H,29,35,37)(H,30,36,38)/t19-,20-,21+,22+,23+,24+,50?,51?/m0/s1 |
| InChIKey | GHWJHLQKPZOTJY-ASDGOFDESA-N |
| Instrument Name | Bruker HX-90 |
| Literature Reference | A.V.LEBEDEV, A.I.REZVUKHIN (1983) Bioorganich.Khim.(Russ. Lang.): v.9, N2, 149-185. |
| NMR Standard | -H3PO4 85% |
| Observed nucleus | 31P |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | C5H5N pyridine |