| SpectraBase Compound ID | Duc6Hpzt3bu |
|---|---|
| InChI | InChI=1S/C13H16ClN4O7P/c1-13(2)24-8-6(3-22-26(19,20)21)23-12(9(8)25-13)18-5-17-7-10(14)15-4-16-11(7)18/h4-6,8-9,12H,3H2,1-2H3,(H2,19,20,21)/t6-,8-,9-,12-/m0/s1 |
| InChIKey | RGJAJLKDYCLAAE-GTBBIVDNSA-N |
| Mol Weight | 406.72 g/mol |
| Molecular Formula | C13H16ClN4O7P |
| Exact Mass | 406.044514 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jwd7nQ3vWp |
|---|---|
| Name | 2',3'-ISOPROPYLIDENE-N6-CHLORO-PURINE-RIBOPYRANOSIDE-5'-MONOPHOSPHATE;CI-AMP-AC |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C13H14ClN4O7P |
| InChI | InChI=1S/C13H16ClN4O7P/c1-13(2)24-8-6(3-22-26(19,20)21)23-12(9(8)25-13)18-5-17-7-10(14)15-4-16-11(7)18/h4-6,8-9,12H,3H2,1-2H3,(H2,19,20,21)/t6-,8-,9-,12-/m0/s1 |
| InChIKey | RGJAJLKDYCLAAE-GTBBIVDNSA-N |
| Literature Reference Author | L.SCHMITT,R.TAMPE |
| Literature Reference Citation | J.AM.CHEM.SOC.,118,5532(1996) |
| Literature Reference DOI | 10.1021/ja953937m |
| Molecular Weight | 404.704 g/mol |
| Sample ID | 55010 |
| Solvent | DMSO |