| SpectraBase Spectrum ID |
3BXZ6s61Ejb |
| Name |
[1R-[1.beta.(1R*,4R*),3a.alpha.,7a.beta.)]]-1-(4-fluoro-5-hydroxy-1,5-dimethylhexyl)octahydro-7a-methyl-4H-inden-4-one |
| Alternate Name(s) |
(1S,3aS,7aS)-1-[(4R)-4-fluoro-5-hydroxy-1,5-dimethylhexyl]-7a-methyloctahydro-4H-inden-4-one |
| CAS Registry Number |
112151-59-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H31FO2 |
| InChI |
InChI=1S/C18H31FO2/c1-12(7-10-16(19)17(2,3)21)13-8-9-14-15(20)6-5-11-18(13,14)4/h12-14,16,21H,5-11H2,1-4H3/t12-,13+,14-,16-,18+/m1/s1 |
| InChIKey |
KPBBYHIEGYHQBE-HUIPPAIASA-N |
| Molecular Weight |
298.442 g/mol |
| SMILES |
OC([C@@](CC[C@]([C@]1([C@]2([C@](CC1)(C(=O)CCC2)[H])C)[H])(C)[H])(F)[H])(C)C |
| SPLASH |
splash10-0pb9-9530000000-3902498b7ac7e8932c6f |
| Source of Spectrum |
J-53-1045-26 |
| Wiley ID |
1301219 |
![[1R-[1.beta.(1R*,4R*),3a.alpha.,7a.beta.)]]-1-(4-fluoro-5-hydroxy-1,5-dimethylhexyl)octahydro-7a-methyl-4H-inden-4-one](/api/spectrum/3BXZ6s61Ejb/structure.png?h=300&w=458 "[1R-[1.beta.(1R*,4R*),3a.alpha.,7a.beta.)]]-1-(4-fluoro-5-hydroxy-1,5-dimethylhexyl)octahydro-7a-methyl-4H-inden-4-one")
