| SpectraBase Compound ID | 4V2EH4yCgeD |
|---|---|
| InChI | InChI=1S/C22H30O4/c1-13(23)26-21-8-7-18-16-6-5-14-11-19(24-3)20(25-4)12-17(14)15(16)9-10-22(18,21)2/h11-12,15-16,18,21H,5-10H2,1-4H3 |
| InChIKey | RTQRMTWBAFCNEM-UHFFFAOYSA-N |
| Mol Weight | 358.48 g/mol |
| Molecular Formula | C22H30O4 |
| Exact Mass | 358.214409 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6O0mLqBVpAq |
|---|---|
| Name | 2,3-Dimethoxyestra-1(10),2,4-trien-17-yl acetate |
| Alternate Name(s) | (2,3-dimethoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) acetate (2,3-dimethoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) ethanoate Acetic acid (2,3-dimethoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) ester Estra-1,3,5(10)-trien-17-ol, 2,3-dimethoxy-, acetate, (17.beta.)- |
| CAS Registry Number | 5976-70-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H30O4 |
| InChI | InChI=1S/C22H30O4/c1-13(23)26-21-8-7-18-16-6-5-14-11-19(24-3)20(25-4)12-17(14)15(16)9-10-22(18,21)2/h11-12,15-16,18,21H,5-10H2,1-4H3 |
| InChIKey | RTQRMTWBAFCNEM-UHFFFAOYSA-N |
| Molecular Weight | 358.478 g/mol |
| SMILES | CC(=O)OC1CCC2C3CCc4cc(c(cc4C3CCC12C)OC)OC |
| SPLASH | splash10-0a4i-0339000000-7fded274bad09bc33b6c |
| Source of Spectrum | W5-0-0-0 |
| Wiley ID | 1347295 |