| SpectraBase Compound ID | ASpj4YCh0By |
|---|---|
| InChI | InChI=1S/C22H31FO4/c1-12(24)26-20-11-17-16(15-5-4-14(23)10-18(15)20)8-9-22(3)19(17)6-7-21(22)27-13(2)25/h14,16-17,19-21H,4-11H2,1-3H3 |
| InChIKey | IBNLCDLIASMJTQ-UHFFFAOYSA-N |
| Mol Weight | 378.48 g/mol |
| Molecular Formula | C22H31FO4 |
| Exact Mass | 378.220638 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ARdNDBI0PUX |
|---|---|
| Name | Estr-5(10)-ene-6.beta.,17.beta.-diol, 3.beta.-fluoro-, diacetate |
| CAS Registry Number | 30882-12-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H31FO4 |
| InChI | InChI=1S/C22H31FO4/c1-12(24)26-20-11-17-16(15-5-4-14(23)10-18(15)20)8-9-22(3)19(17)6-7-21(22)27-13(2)25/h14,16-17,19-21H,4-11H2,1-3H3 |
| InChIKey | IBNLCDLIASMJTQ-UHFFFAOYSA-N |
| Molecular Weight | 378.484 g/mol |
| SMILES | CC12C(C3C(CC2)C2=C(C(C3)OC(C)=O)CC(CC2)F)CCC1OC(C)=O |
| SPLASH | splash10-004i-0259000000-4e080822e40339a32456 |
| Source of Spectrum | O-4-345-11 |
| Synonyms | 17-(Acetyloxy)-3-fluoroestr-5(10)-en-6-yl acetate (6-acetoxy-3-fluoro-13-methyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl) acetate (6-acetyloxy-3-fluoranyl-13-methyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl) ethanoate (6-acetyloxy-3-fluoro-13-methyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl) acetate Acetic acid (6-acetoxy-3-fluoro-13-methyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl) ester Acetic acid (6-acetyloxy-3-fluoro-13-methyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl) ester |
| Wiley ID | 1358862 |