| SpectraBase Compound ID | 3A1nFryqhJJ |
|---|---|
| InChI | InChI=1S/C21H21N3O8/c1-10-9-24(21(30)23-20(10)29)18-7-14(26)16(31-18)8-22-17(27)4-11-5-19(28)32-15-6-12(25)2-3-13(11)15/h2-3,5-6,9,14,16,18,25-26H,4,7-8H2,1H3,(H,22,27)(H,23,29,30)/t14-,16+,18+/m1/s1 |
| InChIKey | HVVRQQIMQCFJTO-HFTRVMKXSA-N |
| Mol Weight | 443.41 g/mol |
| Molecular Formula | C21H21N3O8 |
| Exact Mass | 443.132865 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E12WdSeqiOS |
|---|---|
| Name | 2-(7-HYDROXY-2-OXO-2H-CHROMEN-4-YL)-N-(THYMIDIN-5'-YL)-ACETAMIDE |
| Compound Number | 12A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H21N3O8 |
| InChI | InChI=1S/C21H21N3O8/c1-10-9-24(21(30)23-20(10)29)18-7-14(26)16(31-18)8-22-17(27)4-11-5-19(28)32-15-6-12(25)2-3-13(11)15/h2-3,5-6,9,14,16,18,25-26H,4,7-8H2,1H3,(H,22,27)(H,23,29,30)/t14-,16+,18+/m1/s1 |
| InChIKey | HVVRQQIMQCFJTO-HFTRVMKXSA-N |
| Literature Reference Author | I.KOSIOVA,A.JANICOVA,P.KOIS |
| Literature Reference Citation | BEIL.J.ORG.CHEM.,2,23,1(2006) |
| Literature Reference DOI | 10.1186/1860-5397-2-23 |
| Molecular Weight | 443.413 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWBT10951 |