![BICYCLO-[4.4.1]-UNDECA-3,6,8,10-TETRAEN-2,5-DION-2-(2,4-DINITROPHENYLHYDRAZON)-5-[4-ETHOXYCARBONYL-3-(2'-HYDROXYETHOXY)-1H-PYRAZOL-5-YL]-HYDRAZONE](/api/spectrum/2sbHr0doDiX/structure.png?h=300&w=458 "BICYCLO-[4.4.1]-UNDECA-3,6,8,10-TETRAEN-2,5-DION-2-(2,4-DINITROPHENYLHYDRAZON)-5-[4-ETHOXYCARBONYL-3-(2'-HYDROXYETHOXY)-1H-PYRAZOL-5-YL]-HYDRAZONE")
| SpectraBase Compound ID | wDkk4zEZDT |
|---|---|
| InChI | InChI=1S/C25H24N8O8/c1-2-40-25(35)22-23(30-31-24(22)41-12-11-34)29-27-19-10-9-18(15-5-3-4-6-16(19)13-15)26-28-20-8-7-17(32(36)37)14-21(20)33(38)39/h3-10,14,28,34H,2,11-13H2,1H3,(H2,29,30,31)/b26-18+,27-19+ |
| InChIKey | IUYZMJASYUOFLE-BFNWXZRRSA-N |
| Mol Weight | 564.52 g/mol |
| Molecular Formula | C25H24N8O8 |
| Exact Mass | 564.17171 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2sbHr0doDiX |
|---|---|
| Name | BICYCLO-[4.4.1]-UNDECA-3,6,8,10-TETRAEN-2,5-DION-2-(2,4-DINITROPHENYLHYDRAZON)-5-[4-ETHOXYCARBONYL-3-(2'-HYDROXYETHOXY)-1H-PYRAZOL-5-YL]-HYDRAZONE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H24N8O8 |
| InChI | InChI=1S/C25H24N8O8/c1-2-40-25(35)22-23(30-31-24(22)41-12-11-34)29-27-19-10-9-18(15-5-3-4-6-16(19)13-15)26-28-20-8-7-17(32(36)37)14-21(20)33(38)39/h3-10,14,28,34H,2,11-13H2,1H3,(H2,29,30,31)/b26-18+,27-19+ |
| InChIKey | IUYZMJASYUOFLE-BFNWXZRRSA-N |
| Literature Reference Author | R.NEIDLEIN,A.A.JOHMANN |
| Literature Reference Citation | MH.CHEM.,122,215(1991) |
| Literature Reference DOI | 10.1007/BF00809367 |
| Molecular Weight | 564.514 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWFP641 |