| SpectraBase Compound ID | DmAJGAfpqkY |
|---|---|
| InChI | InChI=1S/C34H28Br4N4O8/c35-21-9-17-2-4-28(21)49-29-15-18(1-3-27(29)43)6-8-40-34(46)26(42-48)14-20-10-22(36)31(44)30(16-20)50-32-23(37)11-19(12-24(32)38)13-25(41-47)33(45)39-7-5-17/h1-4,9-12,15-16,43-44,47-48H,5-8,13-14H2,(H,39,45)(H,40,46)/b41-25+,42-26- |
| InChIKey | XNGIESBQQZJDTL-OOGRQSFXSA-N |
| Mol Weight | 940.2 g/mol |
| Molecular Formula | C34H28Br4N4O8 |
| Exact Mass | 935.864066 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7Y1ViIU7CML |
|---|---|
| Name | BASTADIN-12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H26Br4N4O8 |
| InChI | InChI=1S/C34H28Br4N4O8/c35-21-9-17-2-4-28(21)49-29-15-18(1-3-27(29)43)6-8-40-34(46)26(42-48)14-20-10-22(36)31(44)30(16-20)50-32-23(37)11-19(12-24(32)38)13-25(41-47)33(45)39-7-5-17/h1-4,9-12,15-16,43-44,47-48H,5-8,13-14H2,(H,39,45)(H,40,46)/b41-25+,42-26- |
| InChIKey | XNGIESBQQZJDTL-OOGRQSFXSA-N |
| Literature Reference Author | M.S.BUTLER,T.K.LIM,R.J.CAPON,L.S.HAMMOND |
| Literature Reference Citation | AUSTR.J.CHEM.,44,287(1991) |
| Literature Reference DOI | 10.1071/ch9910287 |
| Molecular Weight | 938.218 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWED16839 |