| SpectraBase Compound ID | BPzIMKMzIVF |
|---|---|
| InChI | InChI=1S/C21H30O3/c1-19-8-5-16(22)12-15(19)2-3-18-17(19)6-9-20-13-14(7-11-24-20)4-10-21(18,20)23/h12,14,17-18,23H,2-11,13H2,1H3/t14-,17?,18?,19+,20+,21-/m1/s1 |
| InChIKey | FNHXMXAVKPEMOO-QLKOGUECSA-N |
| Mol Weight | 330.47 g/mol |
| Molecular Formula | C21H30O3 |
| Exact Mass | 330.219495 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2GOwohvbK6y |
|---|---|
| Name | (20R)-14-.alpha.-Hydroxy-13.beta.,20.-epoxy-17(13-18)-abeo-preg-4-en-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H30O3 |
| InChI | InChI=1S/C21H30O3/c1-19-8-5-16(22)12-15(19)2-3-18-17(19)6-9-20-13-14(7-11-24-20)4-10-21(18,20)23/h12,14,17-18,23H,2-11,13H2,1H3/t14-,17?,18?,19+,20+,21-/m1/s1 |
| InChIKey | FNHXMXAVKPEMOO-QLKOGUECSA-N |
| Molecular Weight | 330.468 g/mol |
| SMILES | O[C@@]12[C@]3(OCC[C@@](CC2)(C3)[H])CCC2[C@]3(CCC(C=C3CCC12)=O)C |
| SPLASH | splash10-052f-9110000000-87cbf2bcb9bbd0724e3b |
| Source of Spectrum | K-2001-1514-6 |
| Wiley ID | 1579234 |