Acetate → 2-Acetyl-5-(2-fluoro-phenyl)-cyclohexane-1,3-dione
Reaction equation
[C:21]([CH:22]1[C:23](=[O:24])[CH2:25][CH:26]([c:27]2[cH:28][cH:29][c:30]([F:31])[cH:32][cH:33]2)[CH2:34][C:35]1=[O:36])(=[O:37])[CH3:38].[CH3:17][C:18]([O-:19])=[O:20].[F:1][c:2]1[c:3]([CH:8]2[CH2:9][C:10](=[O:15])[CH2:11][C:12](=[O:14])[CH2:13]2)[cH:4][cH:5][cH:6][cH:7]1.[Na+:16]>>[F:1][c:2]1[c:3]([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:4][cH:5][cH:6][cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-f7d06a07097d4676b8e7f7eb34b23553
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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