| SpectraBase Compound ID | 170d2ht9hPx |
|---|---|
| InChI | InChI=1S/C27H29N8O11PS/c1-27(2,3)44-26(37)32-20-19(43-25(22(20)36)33-14-31-21-23(28)29-13-30-24(21)33)12-42-47(48,45-17-8-4-15(5-9-17)34(38)39)46-18-10-6-16(7-11-18)35(40)41/h4-11,13-14,19-20,22,25,36H,12H2,1-3H3,(H,32,37)(H2,28,29,30)/t19-,20-,22-,25-/m1/s1 |
| InChIKey | MVYSOSAOMGNMLP-KLPRUGGUSA-N |
| Mol Weight | 704.61 g/mol |
| Molecular Formula | C27H29N8O11PS |
| Exact Mass | 704.141412 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5f37LuiTQ3Q |
|---|---|
| Name | 3'-(N-BOC-AMINO)-3'-DESOXYADENOSIN-5'-THIONOPHOSPHATE-BIS-(PARA-NITROPHENYLESTER) |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H29N8O11PS |
| InChI | InChI=1S/C27H29N8O11PS/c1-27(2,3)44-26(37)32-20-19(43-25(22(20)36)33-14-31-21-23(28)29-13-30-24(21)33)12-42-47(48,45-17-8-4-15(5-9-17)34(38)39)46-18-10-6-16(7-11-18)35(40)41/h4-11,13-14,19-20,22,25,36H,12H2,1-3H3,(H,32,37)(H2,28,29,30)/t19-,20-,22-,25-/m1/s1 |
| InChIKey | MVYSOSAOMGNMLP-KLPRUGGUSA-N |
| Literature Reference Author | M.MORR,L.ERNST |
| Literature Reference Citation | CHEM.BER.,111,2152(1978) |
| Literature Reference DOI | 10.1002/cber.19781110612 |
| Molecular Weight | 704.608 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS8985 |