| SpectraBase Compound ID | 6goebllt7AE |
|---|---|
| InChI | InChI=1S/C28H23F3N6O7/c1-15(38)43-21-19(35-27(41)28(29,30)31)18(12-42-26(40)17-10-6-3-7-11-17)44-25(21)37-14-34-20-22(32-13-33-23(20)37)36-24(39)16-8-4-2-5-9-16/h2-11,13-14,18-19,21,25H,12H2,1H3,(H,35,41)(H,32,33,36,39) |
| InChIKey | DKZMNHGHYFRDCN-UHFFFAOYSA-N |
| Mol Weight | 612.52 g/mol |
| Molecular Formula | C28H23F3N6O7 |
| Exact Mass | 612.158032 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IEmNemxVJnS |
|---|---|
| Name | 2'-O-ACETYL-3'-DEOXY-3'-(TRIFLUORO-ACETAMIDO)-5'-O-BENZOYL-N(6)-BENZOYL-ADENOSINE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H23F3N6O7 |
| InChI | InChI=1S/C28H23F3N6O7/c1-15(38)43-21-19(35-27(41)28(29,30)31)18(12-42-26(40)17-10-6-3-7-11-17)44-25(21)37-14-34-20-22(32-13-33-23(20)37)36-24(39)16-8-4-2-5-9-16/h2-11,13-14,18-19,21,25H,12H2,1H3,(H,35,41)(H,32,33,36,39) |
| InChIKey | DKZMNHGHYFRDCN-UHFFFAOYSA-N |
| Literature Reference Author | G.M.VISSER,C.SCHATTENKERK,J.H.VANBOOM |
| Literature Reference Citation | REC.TR.CH.P.-B.,103,165(1984) |
| Literature Reference DOI | 10.1002/recl.19841030504 |
| Molecular Weight | 612.522 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED3487 |