| SpectraBase Compound ID | 9ID2GJHO2d8 |
|---|---|
| InChI | InChI=1S/C21H31FO4/c1-12(23)26-18-5-4-15-14-10-17(24)21(25)11-13(22)6-9-20(21,3)16(14)7-8-19(15,18)2/h13-16,18,25H,4-11H2,1-3H3 |
| InChIKey | IIQTYURCPFSVCY-UHFFFAOYSA-N |
| Mol Weight | 366.47 g/mol |
| Molecular Formula | C21H31FO4 |
| Exact Mass | 366.220638 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FsDImJb0cG3 |
|---|---|
| Name | 3-Fluoro-5-hydroxy-6-oxoandrostan-17-yl acetate |
| CAS Registry Number | 55723-87-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H31FO4 |
| InChI | InChI=1S/C21H31FO4/c1-12(23)26-18-5-4-15-14-10-17(24)21(25)11-13(22)6-9-20(21,3)16(14)7-8-19(15,18)2/h13-16,18,25H,4-11H2,1-3H3 |
| InChIKey | IIQTYURCPFSVCY-UHFFFAOYSA-N |
| Molecular Weight | 366.473 g/mol |
| SMILES | OC12C(C)(C3C(C4C(CC3)(C)C(OC(C)=O)CC4)CC2=O)CCC(C1)F |
| SPLASH | splash10-02c6-9621000000-b0435cd6cbefeda408ab |
| Source of Spectrum | OS-5-230-0 |
| Synonyms | Androstan-6-one, 17-(acetyloxy)-3-fluoro-5-hydroxy-, (3.beta.,5.beta.,17.beta.)- (3-fluoranyl-10,13-dimethyl-5-oxidanyl-6-oxidanylidene-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl) ethanoate (3-fluoro-5-hydroxy-10,13-dimethyl-6-oxo-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl) acetate Acetic acid (3-fluoro-5-hydroxy-10,13-dimethyl-6-oxo-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl) ester Acetic acid (3-fluoro-5-hydroxy-6-keto-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl) ester |
| Wiley ID | 1352054 |