![Phosphoric acid 2-cyano-ethyl ester [6-(2-oxo-2-phenyl-ethyl)-purin-9-yl]-a-ribofuranos-3-yl ester phenyl ester](/api/spectrum/4RxuHhoAaLh/structure.png?h=300&w=458 "Phosphoric acid 2-cyano-ethyl ester [6-(2-oxo-2-phenyl-ethyl)-purin-9-yl]-a-ribofuranos-3-yl ester phenyl ester")
| SpectraBase Compound ID | CVx1YGdifLQ |
|---|---|
| InChI | InChI=1S/C26H24ClN6O7P/c27-18-9-4-5-10-19(18)39-41(36,37-12-6-11-28)40-20-13-22(38-21(20)14-34)33-16-31-23-24(29-15-30-25(23)33)32-26(35)17-7-2-1-3-8-17/h1-5,7-10,15-16,20-22,34H,6,12-14H2,(H,29,30,32,35)/t20-,21+,22+,41?/m0/s1 |
| InChIKey | NWCUSZKCOKMJIF-SDHLMFEHSA-N |
| Mol Weight | 598.94 g/mol |
| Molecular Formula | C26H24ClN6O7P |
| Exact Mass | 598.113262 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 4RxuHhoAaLh |
|---|---|
| Name | Phosphoric acid 2-cyano-ethyl ester [6-(2-oxo-2-phenyl-ethyl)-purin-9-yl]-a-ribofuranos-3-yl ester phenyl ester |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C26H24ClN6O7P |
| InChI | InChI=1S/C26H24ClN6O7P/c27-18-9-4-5-10-19(18)39-41(36,37-12-6-11-28)40-20-13-22(38-21(20)14-34)33-16-31-23-24(29-15-30-25(23)33)32-26(35)17-7-2-1-3-8-17/h1-5,7-10,15-16,20-22,34H,6,12-14H2,(H,29,30,32,35)/t20-,21+,22+,41?/m0/s1 |
| InChIKey | NWCUSZKCOKMJIF-SDHLMFEHSA-N |
| Instrument Name | Bruker WM-250 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |