| SpectraBase Compound ID | IExnWvG4V9v |
|---|---|
| InChI | InChI=1S/C21H28O3/c1-13(22)24-19-7-6-17-16-5-4-14-12-15(23)8-10-20(14,2)18(16)9-11-21(17,19)3/h8,10,12,16-19H,4-7,9,11H2,1-3H3/t16-,17-,18-,19-,20-,21-/m0/s1 |
| InChIKey | KPCDGGNHYODURF-PXQJOHHUSA-N |
| Mol Weight | 328.45 g/mol |
| Molecular Formula | C21H28O3 |
| Exact Mass | 328.203845 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9iZkcPN8OG |
|---|---|
| Name | ANDROSTA-1,4-DIEN-17-BETA-OL-3-ONE-ACETATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H28O3 |
| InChI | InChI=1S/C21H28O3/c1-13(22)24-19-7-6-17-16-5-4-14-12-15(23)8-10-20(14,2)18(16)9-11-21(17,19)3/h8,10,12,16-19H,4-7,9,11H2,1-3H3/t16-,17-,18-,19-,20-,21-/m0/s1 |
| InChIKey | KPCDGGNHYODURF-PXQJOHHUSA-N |
| Literature Reference Author | H.L.HOLLAND,P.C.CHENCHAIAH |
| Literature Reference Citation | CAN.J.CHEM.,63,1127(1985) |
| Literature Reference DOI | 10.1139/v85-191 |
| Molecular Weight | 328.452 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED1033 |