| SpectraBase Compound ID | 8eiYgVEaAMZ |
|---|---|
| InChI | InChI=1S/C21H25N3O12P2/c1-14-12-24(21(27)23-20(14)26)19-11-17(33-15(2)25)18(34-19)13-32-38(30,31-10-6-9-22)36-37(28,29)35-16-7-4-3-5-8-16/h3-5,7-8,12,17-19H,6,10-11,13H2,1-2H3,(H,28,29)(H,23,26,27)/t17-,18+,19+,38?/m0/s1 |
| InChIKey | ULXQZYFIMMCVEJ-MYQIQNJESA-N |
| Mol Weight | 573.39 g/mol |
| Molecular Formula | C21H25N3O12P2 |
| Exact Mass | 573.091347 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H4htxjT5ZZm |
|---|---|
| Name | 3'-O-ACETYLDEOXYTHYMIDINE-5'-PHENYL(CYANOETHYL)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 | C21H25N3O12P2 |
| InChI | InChI=1S/C21H25N3O12P2/c1-14-12-24(21(27)23-20(14)26)19-11-17(33-15(2)25)18(34-19)13-32-38(30,31-10-6-9-22)36-37(28,29)35-16-7-4-3-5-8-16/h3-5,7-8,12,17-19H,6,10-11,13H2,1-2H3,(H,28,29)(H,23,26,27)/t17-,18+,19+,38?/m0/s1 |
| InChIKey | ULXQZYFIMMCVEJ-MYQIQNJESA-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 |