| SpectraBase Compound ID | 9mDBoXLfEI0 |
|---|---|
| InChI | InChI=1S/C31H52O2/c1-20(2)21(3)8-9-22(4)23-12-14-29(7)25-11-10-24-27(5,19-32)26(33)13-15-30(24)18-31(25,30)17-16-28(23,29)6/h20,22-26,32-33H,3,8-19H2,1-2,4-7H3/t22-,23-,24+,25+,26+,27+,28-,29+,30-,31+/m1/s1 |
| InChIKey | FQXKPPBUTHZNET-NIGXAPAPSA-N |
| Mol Weight | 456.8 g/mol |
| Molecular Formula | C31H52O2 |
| Exact Mass | 456.396731 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DD3xUMhaYfx |
|---|---|
| Name | 24-METHYLENECYCLOARTANE-3,28-DIOL |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H52O2 |
| InChI | InChI=1S/C31H52O2/c1-20(2)21(3)8-9-22(4)23-12-14-29(7)25-11-10-24-27(5,19-32)26(33)13-15-30(24)18-31(25,30)17-16-28(23,29)6/h20,22-26,32-33H,3,8-19H2,1-2,4-7H3/t22-,23-,24+,25+,26+,27+,28-,29+,30-,31+/m1/s1 |
| InChIKey | FQXKPPBUTHZNET-NIGXAPAPSA-N |
| Literature Reference Author | H.HABA,C.LAVAUD,H.HARKAT,A.A.MAGID,L.MARCOURT,M.BENKHALED |
| Literature Reference Citation | PHYTOCHEM.,68,1255(2007) |
| Literature Reference DOI | 10.1016/j.phytochem.2007.01.017 |
| Molecular Weight | 456.753 g/mol |
| Sample ID | 62382 |
| Solvent | CDCl3 |