| SpectraBase Compound ID | 48llmUEv9cq |
|---|---|
| InChI | InChI=1S/C10H15ClN5O13P3/c11-10-14-7(12)4-8(15-10)16(2-13-4)9-6(18)5(17)3(27-9)1-26-31(22,23)29-32(24,25)28-30(19,20)21/h2-3,5-6,9,17-18H,1H2,(H,22,23)(H,24,25)(H2,12,14,15)(H2,19,20,21)/p-4/t3-,5-,6-,9-/m0/s1 |
| InChIKey | RNGCVFCOKZEZFL-GIMIYPNGSA-J |
| Mol Weight | 537.59 g/mol |
| Molecular Formula | C10H11ClN5O13P3 |
| Exact Mass | 536.925474 g/mol |
15N Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GzPnBhOvWNz |
|---|---|
| Name | 2-CHLORO-ADENOSINE-5'-TRIPHOSPHATE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C10H11ClN5O13P3 |
| InChI | InChI=1S/C10H15ClN5O13P3/c11-10-14-7(12)4-8(15-10)16(2-13-4)9-6(18)5(17)3(27-9)1-26-31(22,23)29-32(24,25)28-30(19,20)21/h2-3,5-6,9,17-18H,1H2,(H,22,23)(H,24,25)(H2,12,14,15)(H2,19,20,21)/p-4/t3-,5-,6-,9-/m0/s1 |
| InChIKey | RNGCVFCOKZEZFL-GIMIYPNGSA-J |
| Literature Reference Author | D.T.MAJOR,A.LAXER,B.FISCHER |
| Literature Reference Citation | J.ORG.CHEM.,67,790(2002) |
| Literature Reference DOI | 10.1021/jo0107554 |
| Solvent | H2O;PH=5.41 |
| Source File Reference | UWMS23196 |