| SpectraBase Compound ID | L4AsSzP5sfu |
|---|---|
| InChI | InChI=1S/C20H27FO3/c1-11(22)24-19-6-5-17-15-10-18(23)16-9-12(21)3-4-13(16)14(15)7-8-20(17,19)2/h12,14-15,17,19H,3-10H2,1-2H3 |
| InChIKey | DXAYHQGEQHGOPF-UHFFFAOYSA-N |
| Mol Weight | 334.43 g/mol |
| Molecular Formula | C20H27FO3 |
| Exact Mass | 334.194423 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9zDorw171TO |
|---|---|
| Name | Estra-5(10)-en-6-one, 3.beta.-fluoro-17.beta.-hydroxy-, acetate |
| CAS Registry Number | 33547-52-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H27FO3 |
| InChI | InChI=1S/C20H27FO3/c1-11(22)24-19-6-5-17-15-10-18(23)16-9-12(21)3-4-13(16)14(15)7-8-20(17,19)2/h12,14-15,17,19H,3-10H2,1-2H3 |
| InChIKey | DXAYHQGEQHGOPF-UHFFFAOYSA-N |
| Molecular Weight | 334.431 g/mol |
| SMILES | C1(CCC2=C(C1)C(CC1C3C(C(CC3)OC(C)=O)(CCC21)C)=O)F |
| SPLASH | splash10-000x-6953000000-fe45dd464df53121ae02 |
| Source of Spectrum | O5-0-713-0 |
| Synonyms | 3-Fluoro-6-oxoestr-5(10)-en-17-yl acetate (3-fluoranyl-13-methyl-6-oxidanylidene-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl) ethanoate (3-fluoro-13-methyl-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-13-methyl-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-6-keto-13-methyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl) ester |
| Wiley ID | 1331061 |