| SpectraBase Compound ID | LAGAmv0PWmo |
|---|---|
| InChI | InChI=1S/C22H26O5/c1-12(23)26-15-5-7-16-14(10-15)4-6-18-17(16)8-9-22(3)20(25)11-19(21(18)22)27-13(2)24/h5,7,10,17-19,21H,4,6,8-9,11H2,1-3H3 |
| InChIKey | FFKGLLCBFDXLJS-UHFFFAOYSA-N |
| Mol Weight | 370.45 g/mol |
| Molecular Formula | C22H26O5 |
| Exact Mass | 370.178024 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 49JEvGsjkyo |
|---|---|
| Name | 15-(Acetyloxy)-17-oxoestra-1(10),2,4-trien-3-yl acetate |
| CAS Registry Number | 4349-01-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H26O5 |
| InChI | InChI=1S/C22H26O5/c1-12(23)26-15-5-7-16-14(10-15)4-6-18-17(16)8-9-22(3)20(25)11-19(21(18)22)27-13(2)24/h5,7,10,17-19,21H,4,6,8-9,11H2,1-3H3 |
| InChIKey | FFKGLLCBFDXLJS-UHFFFAOYSA-N |
| Molecular Weight | 370.445 g/mol |
| SMILES | CC(=O)Oc1ccc2c(c1)CCC1C2CCC2(C)C1C(CC2=O)OC(C)=O |
| SPLASH | splash10-014i-1392000000-f04c76f389c00f9188eb |
| Source of Spectrum | W5-0-0-0 |
| Synonyms | (3-acetoxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-15-yl) acetate (3-acetyloxy-13-methyl-17-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-15-yl) ethanoate (3-acetyloxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-15-yl) acetate Acetic acid (3-acetoxy-17-keto-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-15-yl) ester Acetic acid (3-acetyloxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-15-yl) ester Estra-1,3,5(10)-trien-17-one, 3,15-bis(acetyloxy)-, (15.alpha.)- |
| Wiley ID | 1354456 |