| SpectraBase Spectrum ID |
LIk3xAWVEXh |
| Name |
20-Oxopregna-3,5,16-trien-3-yl 2,2,3,3,4,4,4-heptafluorobutanoate |
| Alternate Name(s) |
3-Heptafluorobutyriloxypregna-3,5,16-trien-20-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H27F7O3 |
| InChI |
InChI=1S/C25H27F7O3/c1-13(33)17-6-7-18-16-5-4-14-12-15(8-10-21(14,2)19(16)9-11-22(17,18)3)35-20(34)23(26,27)24(28,29)25(30,31)32/h4,6,12,16,18-19H,5,7-11H2,1-3H3/t16?,18?,19?,21-,22+/m0/s1 |
| InChIKey |
KSCCOTDDOHARJZ-FNPUGNHUSA-N |
| Molecular Weight |
508.477 g/mol |
| SMILES |
C(C(C(OC1=CC2=CCC3C4CC=C([C@]4(CCC3[C@]2(CC1)C)C)C(=O)C)=O)(F)F)(C(F)(F)F)(F)F |
| SPLASH |
splash10-066r-7911020000-8f83eb4f46041b85a76b |
| Source of Spectrum |
JA-6-264-0 |
| Wiley ID |
1400131 |
