| SpectraBase Compound ID | LWtzwa9Kq1t |
|---|---|
| InChI | InChI=1S/C22H30O3/c1-18(2)13-5-6-14-19(3)9-7-16(24)20(19,4)11-17(25)22(14)12-21(13,22)10-8-15(18)23/h8,10,13-14,17,25H,5-7,9,11-12H2,1-4H3/t13-,14-,17+,19-,20+,21+,22-/m0/s1 |
| InChIKey | WDERTWRXKAEKCP-KVIBCQEESA-N |
| Mol Weight | 342.48 g/mol |
| Molecular Formula | C22H30O3 |
| Exact Mass | 342.219495 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B4xC9g4YgCd |
|---|---|
| Name | 11-ALPHA-HYDROXYBUXATENONE;11-ALPHA-HYDROXY-4,4,14-TRIMETHYL-9-BETA,19-CYCLO-5-ALPHA-ANDROST-1-ENE-3,17-DIONE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H30O3 |
| InChI | InChI=1S/C22H30O3/c1-18(2)13-5-6-14-19(3)9-7-16(24)20(19,4)11-17(25)22(14)12-21(13,22)10-8-15(18)23/h8,10,13-14,17,25H,5-7,9,11-12H2,1-4H3/t13-,14-,17+,19-,20+,21+,22-/m0/s1 |
| InChIKey | WDERTWRXKAEKCP-KVIBCQEESA-N |
| Literature Reference Author | A.U.RAHMAN,H.NASIR,Z.IQBAL |
| Literature Reference Citation | PHYTOCHEM.,35,993(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90654-X |
| Molecular Weight | 342.478 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS24404 |