| SpectraBase Compound ID | IrRuU5UzRDS |
|---|---|
| InChI | InChI=1S/C45H48N4O13/c1-52-41(51)45(37(56-25-29-18-10-5-11-19-29)35-33(60-43(45)54-3)27-58-39(62-35)31-22-14-7-15-23-31)47-40(50)44(48-49-46)36(55-24-28-16-8-4-9-17-28)34-32(59-42(44)53-2)26-57-38(61-34)30-20-12-6-13-21-30/h4-23,32-39,42-43H,24-27H2,1-3H3,(H,47,50)/t32-,33-,34-,35-,36+,37+,38-,39-,42+,43+,44-,45-/m1/s1 |
| InChIKey | CHFJSRJFTAYCID-WNJGVORVSA-N |
| Mol Weight | 852.9 g/mol |
| Molecular Formula | C45H48N4O13 |
| Exact Mass | 852.321788 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6uVJI1VnYF |
|---|---|
| Name | CHFJSRJFTAYCID-WNJGVORVSA-N |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H48N4O13 |
| InChI | InChI=1S/C45H48N4O13/c1-52-41(51)45(37(56-25-29-18-10-5-11-19-29)35-33(60-43(45)54-3)27-58-39(62-35)31-22-14-7-15-23-31)47-40(50)44(48-49-46)36(55-24-28-16-8-4-9-17-28)34-32(59-42(44)53-2)26-57-38(61-34)30-20-12-6-13-21-30/h4-23,32-39,42-43H,24-27H2,1-3H3,(H,47,50)/t32-,33-,34-,35-,36+,37+,38-,39-,42+,43+,44-,45-/m1/s1 |
| InChIKey | CHFJSRJFTAYCID-WNJGVORVSA-N |
| Literature Reference Author | A.SCAFFIDI,B.W.SKELTON,R.V.STICK,A.H.WHITE |
| Literature Reference Citation | AUSTR.J.CHEM.,57,733(2004) |
| Literature Reference DOI | 10.1071/CH04014 |
| Molecular Weight | 852.895 g/mol |
| Solvent | Unknown |
| Source File Reference | UWVN20003 |