| SpectraBase Compound ID | 1iWlPrapPwf |
|---|---|
| InChI | InChI=1S/C20H28O5/c1-5-9(2)18(22)24-14-8-20(4)7-11-16(14)17(25-19(11)23)15-10(3)13(21)6-12(15)20/h9,11-14,16-17,21H,5-8H2,1-4H3/t9?,11?,12-,13?,14-,16-,17+,20-/m1/s1 |
| InChIKey | HSJMRBFKPJRDID-FTPPLUIWSA-N |
| Mol Weight | 348.44 g/mol |
| Molecular Formula | C20H28O5 |
| Exact Mass | 348.193674 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2M3zB8sOlcv |
|---|---|
| Name | ROTUNDOPONTILIDE-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H28O5 |
| InChI | InChI=1S/C20H28O5/c1-5-9(2)18(22)24-14-8-20(4)7-11-16(14)17(25-19(11)23)15-10(3)13(21)6-12(15)20/h9,11-14,16-17,21H,5-8H2,1-4H3/t9?,11?,12-,13?,14-,16-,17+,20-/m1/s1 |
| InChIKey | HSJMRBFKPJRDID-FTPPLUIWSA-N |
| Literature Reference Author | M.N.TODOROVA,E.T.TSANKOVA,A.B.TRENDAFILOVA,C.V.GUSSEV |
| Literature Reference Citation | PHYTOCHEM.,41,553(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00640-0 |
| Molecular Weight | 348.439 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU3955 |