Acetate → Methyl 2-cyano-3-phenylbutyrate
Reaction equation
[CH3:18][C:19](=[O:20])[O-:21].[CH3:1][O:2][C:3](=[O:4])[CH2:5][C:6]#[N:7].[CH3:22][C:23](=[O:24])[OH:25].[CH3:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[CH3:8][C:9](=[O:10])[c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1.[NH4+:17]>>[CH3:1][O:2][C:3](=[O:4])[CH:5]([C:6]#[N:7])[CH:9]([CH3:8])[c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1Participants
7
Sources & evidence
- ORD record
- ord-765fede8820c4a9194563d5ab1853751
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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