| SpectraBase Compound ID | 3TDa7KYs5qJ |
|---|---|
| InChI | InChI=1S/C22H26O5/c1-12(23)26-14-4-5-15-16-8-9-22(3)19(6-7-21(22)27-13(2)24)17(16)11-20(25)18(15)10-14/h4-5,10,16-17,19,21H,6-9,11H2,1-3H3 |
| InChIKey | REXFWMANWYNMPV-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 | IUkfLDxAQrh |
|---|---|
| Name | Estra-1,3,5(10)-trien-6-one, 3,17-bis(acetyloxy)-, (17.beta.)- |
| Alternate Name(s) | 17-(Acetyloxy)-6-oxoestra-1,3,5(10)-trien-3-yl acetate (3-acetoxy-13-methyl-6-oxo-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-17-yl) acetate (3-acetyloxy-13-methyl-6-oxidanylidene-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-17-yl) ethanoate (3-acetyloxy-13-methyl-6-oxo-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-17-yl) acetate Acetic acid (3-acetoxy-6-keto-13-methyl-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-17-yl) ester Acetic acid (3-acetyloxy-13-methyl-6-oxo-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-17-yl) ester |
| CAS Registry Number | 3434-45-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H26O5 |
| InChI | InChI=1S/C22H26O5/c1-12(23)26-14-4-5-15-16-8-9-22(3)19(6-7-21(22)27-13(2)24)17(16)11-20(25)18(15)10-14/h4-5,10,16-17,19,21H,6-9,11H2,1-3H3 |
| InChIKey | REXFWMANWYNMPV-UHFFFAOYSA-N |
| Molecular Weight | 370.445 g/mol |
| SMILES | CC12C(C3C(c4c(C(C3)=O)cc(OC(C)=O)cc4)CC2)CCC1OC(C)=O |
| SPLASH | splash10-004i-1569000000-3ec2c48f043e7266a0c8 |
| Source of Spectrum | W5-32115-0-0 |
| Wiley ID | 1354443 |