| SpectraBase Spectrum ID |
B0bt68GiC92 |
| Name |
6-Fluoro-7-dehydrocholesteryl acetate |
| CAS Registry Number |
96109-99-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H45FO2 |
| InChI |
InChI=1S/C29H45FO2/c1-18(2)8-7-9-19(3)23-10-11-24-22-17-27(30)26-16-21(32-20(4)31)12-14-29(26,6)25(22)13-15-28(23,24)5/h17-19,21,23-25H,7-16H2,1-6H3/t19-,21+,23-,24+,25+,28-,29-/m1/s1 |
| InChIKey |
CORKKTSMVOOMQH-UVGMZEHISA-N |
| Molecular Weight |
444.675 g/mol |
| SMILES |
C12=CC(F)=C3[C@@]([C@]2(CC[C@]2([C@]1(CC[C@@]2([C@@](CCCC(C)C)(C)[H])[H])[H])C)[H])(CC[C@](OC(=O)C)(C3)[H])C |
| SPLASH |
splash10-0bu0-2915000000-afb05722580ec22adc76 |
| Source of Spectrum |
J-50-2009-4 |
| Synonyms |
(3beta)-6-fluorocholesta-5,7-dien-3-yl acetate |
| Wiley ID |
1386153 |
