| SpectraBase Compound ID | 36rLly2fHrO |
|---|---|
| InChI | InChI=1S/C22H32ClN4O9P/c1-13-18(27-21(31)35-22(2,3)4)20(30)25-10-17(28)26-16(19(29)24-5)12-34-37(32,36-13)33-11-14-6-8-15(23)9-7-14/h6-9,13,16,18H,10-12H2,1-5H3,(H,24,29)(H,25,30)(H,26,28)(H,27,31) |
| InChIKey | MJVDRQYFUJOQDB-UHFFFAOYSA-N |
| Mol Weight | 562.9 g/mol |
| Molecular Formula | C22H32ClN4O9P |
| Exact Mass | 562.159543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JrLW6Guykio |
|---|---|
| Name | MJVDRQYFUJOQDB-UHFFFAOYSA-N |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H32ClN4O9P |
| InChI | InChI=1S/C22H32ClN4O9P/c1-13-18(27-21(31)35-22(2,3)4)20(30)25-10-17(28)26-16(19(29)24-5)12-34-37(32,36-13)33-11-14-6-8-15(23)9-7-14/h6-9,13,16,18H,10-12H2,1-5H3,(H,24,29)(H,25,30)(H,26,28)(H,27,31) |
| InChIKey | MJVDRQYFUJOQDB-UHFFFAOYSA-N |
| Literature Reference Author | A.H.VANOIJEN,C.ERKELENS,J.H.VANBOOM,R.M.J.LISKAMP |
| Literature Reference Citation | J.AM.CHEM.SOC.,111,9102(1989) |
| Literature Reference DOI | 10.1021/ja00207a018 |
| Molecular Weight | 562.944 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCS10525 |