| SpectraBase Compound ID | 5wh0GcqbH5F |
|---|---|
| InChI | InChI=1S/C23H25F7O3/c1-19-9-7-13(33-18(32)21(24,25)22(26,27)23(28,29)30)11-12(19)3-4-14-15-5-6-17(31)20(15,2)10-8-16(14)19/h3,11,14-16H,4-10H2,1-2H3 |
| InChIKey | ZVALUAVQFFVNCZ-UHFFFAOYSA-N |
| Mol Weight | 482.44 g/mol |
| Molecular Formula | C23H25F7O3 |
| Exact Mass | 482.169192 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JM32TSs3BhR |
|---|---|
| Name | Androsta-3,5-dien-17-one, 3-hydroxy-, heptafluorobutyrate |
| CAS Registry Number | 18072-19-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H25F7O3 |
| InChI | InChI=1S/C23H25F7O3/c1-19-9-7-13(33-18(32)21(24,25)22(26,27)23(28,29)30)11-12(19)3-4-14-15-5-6-17(31)20(15,2)10-8-16(14)19/h3,11,14-16H,4-10H2,1-2H3 |
| InChIKey | ZVALUAVQFFVNCZ-UHFFFAOYSA-N |
| Molecular Weight | 482.439 g/mol |
| SMILES | CC12C3C(C4C(CC3)(C)C(=O)CC4)CC=C2C=C(CC1)OC(C(C(C(F)(F)F)(F)F)(F)F)=O |
| SPLASH | splash10-001i-5401900000-eaa0b49ea3e9a63b0753 |
| Source of Spectrum | AD-0-2745-0 |
| Synonyms | 17-Oxoandrosta-3,5-dien-3-yl 2,2,3,3,4,4,4-heptafluorobutanoate (10,13-dimethyl-17-oxidanylidene-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-yl) 2,2,3,3,4,4,4-heptakis(fluoranyl)butanoate (10,13-dimethyl-17-oxo-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-yl) 2,2,3,3,4,4,4-heptafluorobutanoate 2,2,3,3,4,4,4-heptafluorobutanoic acid (10,13-dimethyl-17-oxo-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-yl) ester 2,2,3,3,4,4,4-heptafluorobutyric acid (17-keto-10,13-dimethyl-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-yl) ester Androst-4-ene-3,17-dione enol heptafluorobutyrate |
| Wiley ID | 1395548 |