| SpectraBase Compound ID | 8pmHx1xmmCx |
|---|---|
| InChI | InChI=1S/C30H35ClN4O17P2/c1-15-11-34(29(40)32-27(15)38)25-9-21(47-17(3)36)23(49-25)13-45-53(42,43)52-54(44,51-20-7-5-19(31)6-8-20)46-14-24-22(48-18(4)37)10-26(50-24)35-12-16(2)28(39)33-30(35)41/h5-8,11-12,21-26H,9-10,13-14H2,1-4H3,(H,42,43)(H,32,38,40)(H,33,39,41)/t21-,22-,23+,24+,25+,26+,54?/m0/s1 |
| InChIKey | VCCWLQGNDULFBO-CLNNYEBKSA-N |
| Mol Weight | 821.0 g/mol |
| Molecular Formula | C30H35ClN4O17P2 |
| Exact Mass | 820.116097 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I6BeA4ZHYRB |
|---|---|
| Name | BIS(3'-O-ACETYLDEOXYTHYMIDIN-5'-YL)PARA-CHLOROPHENYLPYROPHOSPHATE |
| Comments | , SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED (S.T.) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C30H35ClN4O17P2 |
| InChI | InChI=1S/C30H35ClN4O17P2/c1-15-11-34(29(40)32-27(15)38)25-9-21(47-17(3)36)23(49-25)13-45-53(42,43)52-54(44,51-20-7-5-19(31)6-8-20)46-14-24-22(48-18(4)37)10-26(50-24)35-12-16(2)28(39)33-30(35)41/h5-8,11-12,21-26H,9-10,13-14H2,1-4H3,(H,42,43)(H,32,38,40)(H,33,39,41)/t21-,22-,23+,24+,25+,26+,54?/m0/s1 |
| InChIKey | VCCWLQGNDULFBO-CLNNYEBKSA-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 |