| SpectraBase Spectrum ID |
H71xjOvS94R |
| Name |
20-Oxopregna-3,5,9(11)-trien-3-yl 2,2,3,3,4,4,4-heptafluorobutanoate |
| Alternate Name(s) |
3-Heptafluorobutyriloxy-3,5,10-pregnatrien-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/h4,9,12,16-18H,5-8,10-11H2,1-3H3/t16?,17?,18?,21-,22+/m0/s1 |
| InChIKey |
OLEKIXMSHUSNMD-HMZIDYQKSA-N |
| Molecular Weight |
508.477 g/mol |
| SMILES |
C(C(C(OC1=CC2=CCC3C([C@]2(CC1)C)=CC[C@@]1(C(C(=O)C)CCC31)C)=O)(F)F)(C(F)(F)F)(F)F |
| SPLASH |
splash10-0aou-9612210000-0e0ae412086b9507ac8d |
| Source of Spectrum |
JA-6-264-0 |
| Wiley ID |
1400132 |
