Ammonia → 2,5-Cyclohexadien-1-one, 4-hydroxy-4-(phenylethynyl)-
Reaction equation
[C:12]1(=[O:19])[CH:13]=[CH:14][C:15](=[O:18])[CH:16]=[CH:17]1.[CH2:20]1[O:21][CH2:22][CH2:23][CH2:24]1.[NH2-:2].[NH3:11].[Na:1].[c:3]1([C:9]#[CH:10])[cH:4][cH:5][cH:6][cH:7][cH:8]1>>[c:3]1([C:9]#[C:10][C:15]2([OH:18])[CH:14]=[CH:13][C:12](=[O:19])[CH:17]=[CH:16]2)[cH:4][cH:5][cH:6][cH:7][cH:8]1Participants
7
Sources & evidence
- ORD record
- ord-2a3f3a089ef14a49bc159347263f90f9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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