| SpectraBase Compound ID | Er7Zx2qL9UB |
|---|---|
| InChI | InChI=1S/C41H64O/c1-34(2)20-14-23-37(5)26-17-29-38(6)27-15-24-35(3)21-12-13-22-36(4)25-16-28-39(7)30-18-31-40(8)32-19-33-41(9,10)42-11/h12-13,15-16,18,20-22,24-28,30,40H,14,17,19,23,29,31-33H2,1-11H3/b13-12+,24-15+,25-16+,30-18+,35-21+,36-22+,37-26+,38-27+,39-28+ |
| InChIKey | QRTSDXRMMBECRN-OUESVDFQSA-N |
| Mol Weight | 573.0 g/mol |
| Molecular Formula | C41H64O |
| Exact Mass | 572.495717 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jxk1mohqCM0 |
|---|---|
| Name | ALL-E-3,4,5,6-TETRAHYDROSPHEROIDENE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H64O |
| InChI | InChI=1S/C41H64O/c1-34(2)20-14-23-37(5)26-17-29-38(6)27-15-24-35(3)21-12-13-22-36(4)25-16-28-39(7)30-18-31-40(8)32-19-33-41(9,10)42-11/h12-13,15-16,18,20-22,24-28,30,40H,14,17,19,23,29,31-33H2,1-11H3/b13-12+,24-15+,25-16+,30-18+,35-21+,36-22+,37-26+,38-27+,39-28+ |
| InChIKey | QRTSDXRMMBECRN-OUESVDFQSA-N |
| Literature Reference Author | R.GEBHARD,J.T.M.VANDIJK,E.VANOUWERKERK,M.V.T.J.BOZA,J.LUGTEN BURG |
| Literature Reference Citation | REC.TR.CH.P.-B.,110,459(1991) |
| Literature Reference DOI | 10.1002/recl.19911101105 |
| Molecular Weight | 572.959 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS2276 |