Acetate → 4-(2-Acetyl-3-oxo-1-butenyl)benzonitrile
Reaction equation
[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]([CH:7]=[O:8])[cH:9][cH:10]1.[CH3:11][C:12]([CH2:13][C:14]([CH3:15])=[O:16])=[O:17].[CH3:19][C:20](=[O:21])[O-:22].[CH3:23][CH:24]([OH:25])[CH3:26].[NH4+:18]>>[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]([CH:7]=[C:13]([C:12]([CH3:11])=[O:17])[C:14]([CH3:15])=[O:16])[cH:9][cH:10]1Participants
6
Sources & evidence
- ORD record
- ord-e7972f7661eb4d5cb17d20e5d9da8346
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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