Acetate → 1-Amino-5-(5-fluoro-2-methylphenyl)cyclohexen-3-one
Reaction equation
[CH3:18][C:19](=[O:20])[O-:21].[CH3:22][CH2:23][OH:24].[F:1][c:2]1[cH:3][cH:4][c:5]([CH3:16])[c:6]([CH:8]2[CH2:9][C:10](=[O:15])[CH2:11][C:12](=[O:14])[CH2:13]2)[cH:7]1.[NH4+:17]>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH3:16])[c:6]([CH:8]2[CH2:9][C:10](=[O:15])[CH:11]=[C:12]([NH2:17])[CH2:13]2)[cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-b5868b1ac42349ac96ee91976b755727
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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