| SpectraBase Compound ID | E9E84oZvyjg |
|---|---|
| InChI | InChI=1S/2C20H27N4O10PSSe/c2*1-9-5-23(19(29)21-17(9)27)15-3-11(26)14(33-15)8-31-35(36,37)34-12-4-16(32-13(12)7-25)24-6-10(2)18(28)22-20(24)30/h2*5-6,11-16,25-26H,3-4,7-8H2,1-2H3,(H,36,37)(H,21,27,29)(H,22,28,30)/p-2/t2*11-,12+,13-,14+,15+,16-,35?/m00/s1 |
| InChIKey | KMJMQMJDMXBZCC-KGAZVAAHSA-L |
| Mol Weight | 1248.9 g/mol |
| Molecular Formula | C40H52N8O20P2S2Se2 |
| Exact Mass | 1250.054496 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KPzOafEkkia |
|---|---|
| Name | DITHYMIDYLYL-3',5'-PHOSPHOROTHIOSELENOATE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H52N8O20P2S2Se2 |
| InChI | InChI=1S/2C20H27N4O10PSSe/c2*1-9-5-23(19(29)21-17(9)27)15-3-11(26)14(33-15)8-31-35(36,37)34-12-4-16(32-13(12)7-25)24-6-10(2)18(28)22-20(24)30/h2*5-6,11-16,25-26H,3-4,7-8H2,1-2H3,(H,36,37)(H,21,27,29)(H,22,28,30)/p-2/t2*11-,12+,13-,14+,15+,16-,35?/m00/s1 |
| InChIKey | KMJMQMJDMXBZCC-KGAZVAAHSA-L |
| Literature Reference Author | K.MISIURA,D.SZYMANOWICZ,H.KUSNIERCZYK |
| Literature Reference Citation | BIOORG.MED.CHEM.,9,1525(2001) |
| Literature Reference DOI | 10.1016/S0968-0896(01)00025-6 |
| Solvent | D2O |
| Source File Reference | UWSI21097 |