| SpectraBase Compound ID | Cz2T5Y1YQX5 |
|---|---|
| InChI | InChI=1S/C21H36O13/c22-6-11-13(23)15(25)17(27)20(32-11)30-9-12-14(24)16(26)18(28)19(33-12)29-7-10-8-31-21(34-10)4-2-1-3-5-21/h10-20,22-28H,1-9H2/t10-,11-,12+,13-,14+,15+,16-,17-,18+,19+,20-/m0/s1 |
| InChIKey | HDMNIQPIMBAEJM-OFQOSQOQSA-N |
| Mol Weight | 496.5 g/mol |
| Molecular Formula | C21H36O13 |
| Exact Mass | 496.215591 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FpL7QHIepgS |
|---|---|
| Name | INTERMEDIATE-A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H36O13 |
| InChI | InChI=1S/C21H36O13/c22-6-11-13(23)15(25)17(27)20(32-11)30-9-12-14(24)16(26)18(28)19(33-12)29-7-10-8-31-21(34-10)4-2-1-3-5-21/h10-20,22-28H,1-9H2/t10-,11-,12+,13-,14+,15+,16-,17-,18+,19+,20-/m0/s1 |
| InChIKey | HDMNIQPIMBAEJM-OFQOSQOQSA-N |
| Literature Reference Author | W.F.J.HOGENDORF,V.JAGALSKI,T.G.POMORSKI,M.BOLS,M.CARDENAS,C. M.PEDERSEN |
| Literature Reference Citation | MOLECULES,18,13546(2013) |
| Literature Reference DOI | 10.3390/molecules181113546 |
| Molecular Weight | 496.509 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWIR9845 |