| SpectraBase Compound ID | F0bZXRKFgiw |
|---|---|
| InChI | InChI=1S/C32H38N6O13P2/c1-19-15-37(31(43)33-29(19)41)27-13-23(39)25(49-27)17-47-52(45,35-21-9-5-3-6-10-21)51-53(46,36-22-11-7-4-8-12-22)48-18-26-24(40)14-28(50-26)38-16-20(2)30(42)34-32(38)44/h3-12,15-16,23-28,39-40H,13-14,17-18H2,1-2H3,(H,35,45)(H,36,46)(H,33,41,43)(H,34,42,44)/t23-,24-,25+,26+,27+,28+,52?,53?/m0/s1 |
| InChIKey | ODEFATUFPPJNTC-QWNBBGPGSA-N |
| Mol Weight | 776.6 g/mol |
| Molecular Formula | C32H38N6O13P2 |
| Exact Mass | 776.197209 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LVSiMevzaUS |
|---|---|
| Name | P,P'-DIANILIDO-P,P'-BIS(DEOXYTHYMIDIN-5'-YL)PYROPHOSPHATE(DIASTEREOMER MIXTURE) |
| Comments | , -7.4:-8.0 - RANGE. SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C32H38N6O13P2 |
| InChI | InChI=1S/C32H38N6O13P2/c1-19-15-37(31(43)33-29(19)41)27-13-23(39)25(49-27)17-47-52(45,35-21-9-5-3-6-10-21)51-53(46,36-22-11-7-4-8-12-22)48-18-26-24(40)14-28(50-26)38-16-20(2)30(42)34-32(38)44/h3-12,15-16,23-28,39-40H,13-14,17-18H2,1-2H3,(H,35,45)(H,36,46)(H,33,41,43)(H,34,42,44)/t23-,24-,25+,26+,27+,28+,52?,53?/m0/s1 |
| InChIKey | ODEFATUFPPJNTC-QWNBBGPGSA-N |
| Instrument Name | Bruker HX-90 |
| Literature Reference | A.V.LEBEDEV, A.I.REZVUKHIN (REVIEW) (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 |