| SpectraBase Compound ID | 6PXj0kyiRdB |
|---|---|
| InChI | InChI=1S/C28H44O2/c1-17(2)18(3)7-8-19(4)26-25(30)16-24-22-10-9-20-15-21(29)11-13-27(20,5)23(22)12-14-28(24,26)6/h9,17,19,21-24,26,29H,3,7-8,10-16H2,1-2,4-6H3/t19-,21+,22-,23+,24+,26+,27+,28+/m1/s1 |
| InChIKey | KJJMHRHVXJHQBU-BWPITKIYSA-N |
| Mol Weight | 412.7 g/mol |
| Molecular Formula | C28H44O2 |
| Exact Mass | 412.334131 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BMuEPWe9YvP |
|---|---|
| Name | 3-BETA-HYDROXYERGOSTA-5,24(28)-DIEN-16-ONE |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H44O2 |
| InChI | InChI=1S/C28H44O2/c1-17(2)18(3)7-8-19(4)26-25(30)16-24-22-10-9-20-15-21(29)11-13-27(20,5)23(22)12-14-28(24,26)6/h9,17,19,21-24,26,29H,3,7-8,10-16H2,1-2,4-6H3/t19-,21+,22-,23+,24+,26+,27+,28+/m1/s1 |
| InChIKey | KJJMHRHVXJHQBU-BWPITKIYSA-N |
| Literature Reference Author | B.BIAN,I.A.VANALTENA |
| Literature Reference Citation | AUSTR.J.CHEM.,51,1157(1998) |
| Literature Reference DOI | 10.1071/C98008 |
| Molecular Weight | 412.656 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS21843 |