![1-[4-[3,5-DI-(4-ACETYLPHENOXYMETHYL)-BEZYLOXY]-PHENYL]-1-ETHANONE-N-ETHOXYCARBONYLHYDRAZONE](/api/spectrum/25zUqcWDzD9/structure.png?h=300&w=458 "1-[4-[3,5-DI-(4-ACETYLPHENOXYMETHYL)-BEZYLOXY]-PHENYL]-1-ETHANONE-N-ETHOXYCARBONYLHYDRAZONE")
| SpectraBase Compound ID | BnXuYgaQRf1 |
|---|---|
| InChI | InChI=1S/C42H48N6O9/c1-7-52-40(49)46-43-28(4)34-10-16-37(17-11-34)55-25-31-22-32(26-56-38-18-12-35(13-19-38)29(5)44-47-41(50)53-8-2)24-33(23-31)27-57-39-20-14-36(15-21-39)30(6)45-48-42(51)54-9-3/h10-24H,7-9,25-27H2,1-6H3,(H,46,49)(H,47,50)(H,48,51)/b43-28+,44-29+,45-30+ |
| InChIKey | TZQJKBMHFWUXQT-HWLVQMDZSA-N |
| Mol Weight | 780.9 g/mol |
| Molecular Formula | C42H48N6O9 |
| Exact Mass | 780.348277 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 25zUqcWDzD9 |
|---|---|
| Name | 1-[4-[3,5-DI-(4-ACETYLPHENOXYMETHYL)-BEZYLOXY]-PHENYL]-1-ETHANONE-N-ETHOXYCARBONYLHYDRAZONE |
| Compound Number | 4B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H48N6O9 |
| InChI | InChI=1S/C42H48N6O9/c1-7-52-40(49)46-43-28(4)34-10-16-37(17-11-34)55-25-31-22-32(26-56-38-18-12-35(13-19-38)29(5)44-47-41(50)53-8-2)24-33(23-31)27-57-39-20-14-36(15-21-39)30(6)45-48-42(51)54-9-3/h10-24H,7-9,25-27H2,1-6H3,(H,46,49)(H,47,50)(H,48,51)/b43-28+,44-29+,45-30+ |
| InChIKey | TZQJKBMHFWUXQT-HWLVQMDZSA-N |
| Literature Reference Author | M.AL-SMADI,S.RATROUT |
| Literature Reference Citation | J.HETCYCL.CHEM.,41,887(2004) |
| Literature Reference DOI | 10.1002/jhet.5570410607 |
| Molecular Weight | 780.878 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU22516 |