| SpectraBase Compound ID | 22kwoptnTBm |
|---|---|
| InChI | InChI=1S/C15H16ClN3O4/c16-9-1-3-10(4-2-9)17-15-18-13(22)5-6-19(15)14-7-11(21)12(8-20)23-14/h1-6,11-12,14,20-21H,7-8H2,(H,17,18,22)/t11-,12+,14+/m0/s1 |
| InChIKey | GASVYUCOJTZQAQ-OUCADQQQSA-N |
| Mol Weight | 337.76 g/mol |
| Molecular Formula | C15H16ClN3O4 |
| Exact Mass | 337.082934 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 59ck3W6J3PG |
|---|---|
| Name | 1-(2-DEOXY-BETA-D-RIBOFURANOSYL)-2-(4-CHLOROPHENYLAMINO)-4-PYRIMIDINONE |
| Compound Number | 9C |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C15H16ClN3O4 |
| InChI | InChI=1S/C15H16ClN3O4/c16-9-1-3-10(4-2-9)17-15-18-13(22)5-6-19(15)14-7-11(21)12(8-20)23-14/h1-6,11-12,14,20-21H,7-8H2,(H,17,18,22)/t11-,12+,14+/m0/s1 |
| InChIKey | GASVYUCOJTZQAQ-OUCADQQQSA-N |
| Literature Reference Author | O.M.ALI |
| Literature Reference Citation | MH.CHEM.,138,917(2007) |
| Literature Reference DOI | 10.1007/s00706-007-0671-9 |
| Molecular Weight | 337.763 g/mol |
| Sample ID | 68700 |
| Solvent | DMSO-D6 |