| SpectraBase Compound ID | KgHoOW6U42O |
|---|---|
| InChI | InChI=1S/C25H27Br4N3O7/c1-13(33)30-7-5-15-9-16(26)21(17(27)10-15)37-8-4-6-31-24(35)19-12-25(39-32-19)11-18(28)22(36-3)20(29)23(25)38-14(2)34/h9-11,23H,4-8,12H2,1-3H3,(H,30,33)(H,31,35) |
| InChIKey | PNKDABJLNHYIPH-UHFFFAOYSA-N |
| Mol Weight | 801.12 g/mol |
| Molecular Formula | C25H27Br4N3O7 |
| Exact Mass | 796.858252 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CydESYxa3R1 |
|---|---|
| Name | DIACETYL-HEXADELLIN-A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H27Br4N3O7 |
| InChI | InChI=1S/C25H27Br4N3O7/c1-13(33)30-7-5-15-9-16(26)21(17(27)10-15)37-8-4-6-31-24(35)19-12-25(39-32-19)11-18(28)22(36-3)20(29)23(25)38-14(2)34/h9-11,23H,4-8,12H2,1-3H3,(H,30,33)(H,31,35) |
| InChIKey | PNKDABJLNHYIPH-UHFFFAOYSA-N |
| Literature Reference Author | S.A.MORRIS,R.J.ANDERSEN |
| Literature Reference Citation | CAN.J.CHEM.,67,677(1989) |
| Literature Reference DOI | 10.1139/v89-102 |
| Molecular Weight | 801.121 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED5046 |