Acetate → 2-Acetyl-5-(4-fluoro-phenyl)cyclohexane-1,3-dione
Reaction equation
[CH3:17][C:18]([O-:19])=[O:20].[CH3:21][CH2:22][O:23][C:24](=[O:25])[CH3:26].[CH3:28][C:29]([O:30][C:31](=[O:32])[CH3:33])=[O:34].[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[CH2:9][C:10](=[O:15])[CH2:11][C:12](=[O:14])[CH2:13]2)[cH:6][cH:7]1.[Na+:16].[OH2:27]>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[CH2:9][C:10](=[O:15])[CH:11]([C:18]([CH3:17])=[O:19])[C:12](=[O:14])[CH2:13]2)[cH:6][cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-e962b827e1ca4d82bdf3a2644c4ebbd6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
Loading…