![6,25-DIBENZYL-5,6,7,8,9,10,11,12,13,14,15,16,17,18,24,25,26,27,28,29,30,31,32,33,34,35,36,37-OCTAICOSAHYDRODIBENZO-[B,S]-[1,18,5,22]-DIOXADIAZACY](/api/spectrum/zIy2yaf7pM/structure.png?h=300&w=458 "6,25-DIBENZYL-5,6,7,8,9,10,11,12,13,14,15,16,17,18,24,25,26,27,28,29,30,31,32,33,34,35,36,37-OCTAICOSAHYDRODIBENZO-[B,S]-[1,18,5,22]-DIOXADIAZACY")
| SpectraBase Compound ID | I6OfKWzBsav |
|---|---|
| InChI | InChI=1S/C52H74N2O2/c1-3-7-11-15-29-41-55-51-37-25-24-36-50(51)46-54(44-48-33-21-18-22-34-48)40-28-14-10-6-2-4-8-12-16-30-42-56-52-38-26-23-35-49(52)45-53(39-27-13-9-5-1)43-47-31-19-17-20-32-47/h17-26,31-38H,1-16,27-30,39-46H2 |
| InChIKey | RMGLAJSQUNSQRX-UHFFFAOYSA-N |
| Mol Weight | 759.2 g/mol |
| Molecular Formula | C52H74N2O2 |
| Exact Mass | 758.57503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | zIy2yaf7pM |
|---|---|
| Name | 6,25-DIBENZYL-5,6,7,8,9,10,11,12,13,14,15,16,17,18,24,25,26,27,28,29,30,31,32,33,34,35,36,37-OCTAICOSAHYDRODIBENZO-[B,S]-[1,18,5,22]-DIOXADIAZACY |
| Compound Number | 16A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H74N2O2 |
| InChI | InChI=1S/C52H74N2O2/c1-3-7-11-15-29-41-55-51-37-25-24-36-50(51)46-54(44-48-33-21-18-22-34-48)40-28-14-10-6-2-4-8-12-16-30-42-56-52-38-26-23-35-49(52)45-53(39-27-13-9-5-1)43-47-31-19-17-20-32-47/h17-26,31-38H,1-16,27-30,39-46H2 |
| InChIKey | RMGLAJSQUNSQRX-UHFFFAOYSA-N |
| Literature Reference Author | D.J.BERGMANN,E.M.CAMPI,W.R.JACKSON,A.F.PATTI,D.SAYLIK |
| Literature Reference Citation | AUSTR.J.CHEM.,53,835(2000) |
| Literature Reference DOI | 10.1071/CH00112 |
| Molecular Weight | 759.172 g/mol |
| Solvent | Unknown |
| Source File Reference | UWSI3110 |