| SpectraBase Compound ID | FdWO28eaoAc |
|---|---|
| InChI | InChI=1S/C20H22O4/c1-11(21)24-12-3-4-13-14-7-8-20(2)17(5-6-19(20)23)15(14)10-18(22)16(13)9-12/h3-4,9,14-15,17H,5-8,10H2,1-2H3 |
| InChIKey | AEDBWXZHICCQMQ-UHFFFAOYSA-N |
| Mol Weight | 326.39 g/mol |
| Molecular Formula | C20H22O4 |
| Exact Mass | 326.151809 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2uzO2Ww9zeb |
|---|---|
| Name | 6,17-Dioxoestra-1,3,5(10)-trien-3-yl acetate |
| Alternate Name(s) | (13-methyl-6,17-dioxo-7,8,9,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-yl) acetate Acetic acid (13-methyl-6,17-dioxo-7,8,9,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-yl) ester Acetic acid (6,17-diketo-13-methyl-7,8,9,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-yl) ester Estra-1,3,5(10)-triene-6,17-dione, 3-(acetyloxy)- |
| CAS Registry Number | 7323-89-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H22O4 |
| InChI | InChI=1S/C20H22O4/c1-11(21)24-12-3-4-13-14-7-8-20(2)17(5-6-19(20)23)15(14)10-18(22)16(13)9-12/h3-4,9,14-15,17H,5-8,10H2,1-2H3 |
| InChIKey | AEDBWXZHICCQMQ-UHFFFAOYSA-N |
| Molecular Weight | 326.392 g/mol |
| SMILES | CC(=O)Oc1ccc2c(c1)C(CC1C2CCC2(C)C1CCC2=O)=O |
| SPLASH | splash10-001i-0290000000-4891b215da31fbebebfa |
| Source of Spectrum | W5-0-0-0 |
| Wiley ID | 1324950 |