| SpectraBase Compound ID | 8uuUIdax38o |
|---|---|
| InChI | InChI=1S/C34H25Br5N4O8/c35-20-7-16-1-2-27(20)50-28-14-17(8-21(36)30(28)44)4-6-41-33(46)25(42-48)12-18-10-23(38)32(24(39)11-18)51-29-15-19(9-22(37)31(29)45)13-26(43-49)34(47)40-5-3-16/h1-3,5,7-11,14-15,44-45,48-49H,4,6,12-13H2,(H,40,47)(H,41,46)/b5-3+,42-25-,43-26- |
| InChIKey | YCBNAUHIFJRIQW-GLKJARMSSA-N |
| Mol Weight | 1017.1 g/mol |
| Molecular Formula | C34H25Br5N4O8 |
| Exact Mass | 1011.758929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JyWYzfa3xvf |
|---|---|
| Name | BASTADIN-4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H23Br5N4O8 |
| InChI | InChI=1S/C34H25Br5N4O8/c35-20-7-16-1-2-27(20)50-28-14-17(8-21(36)30(28)44)4-6-41-33(46)25(42-48)12-18-10-23(38)32(24(39)11-18)51-29-15-19(9-22(37)31(29)45)13-26(43-49)34(47)40-5-3-16/h1-3,5,7-11,14-15,44-45,48-49H,4,6,12-13H2,(H,40,47)(H,41,46)/b5-3+,42-25-,43-26- |
| InChIKey | YCBNAUHIFJRIQW-GLKJARMSSA-N |
| Literature Reference Author | E.O.PORDESIMO,F.J.SCHMITZ |
| Literature Reference Citation | J.ORG.CHEM.,55,4704(1990) |
| Literature Reference DOI | 10.1021/jo00302a041 |
| Molecular Weight | 1015.099 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWED6151 |