| SpectraBase Compound ID | BRoRb1CUP5C |
|---|---|
| InChI | InChI=1S/2C18H31NO11/c2*1-8(21)19-11-16-15(9(6-20)28-17(11)25-2)30-18-14(24)13(23)12(22)10(29-18)7-26-4-3-5-27-16/h2*9-18,20,22-24H,3-7H2,1-2H3,(H,19,21)/t2*9-,10+,11-,12-,13-,14+,15-,16-,17-,18+/m00/s1 |
| InChIKey | LJMMOGLNICHJBZ-WTJOGHBQSA-N |
| Mol Weight | 874.88 g/mol |
| Molecular Formula | C36H62N2O22 |
| Exact Mass | 874.379422 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | c72gNDUbyM |
|---|---|
| Name | LJMMOGLNICHJBZ-WTJOGHBQSA-N |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H62N2O22 |
| InChI | InChI=1S/2C18H31NO11/c2*1-8(21)19-11-16-15(9(6-20)28-17(11)25-2)30-18-14(24)13(23)12(22)10(29-18)7-26-4-3-5-27-16/h2*9-18,20,22-24H,3-7H2,1-2H3,(H,19,21)/t2*9-,10+,11-,12-,13-,14+,15-,16-,17-,18+/m00/s1 |
| InChIKey | LJMMOGLNICHJBZ-WTJOGHBQSA-N |
| Literature Reference Author | S.A.WACOWICH-SGARBI,C.C.LING,A.OTTER,D.R.BUNDLE |
| Literature Reference Citation | J.AM.CHEM.SOC.,123,4362(2001) |
| Literature Reference DOI | 10.1021/ja005901m |
| Molecular Weight | 874.888 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU30591 |