Hexane → 1-Hydroxy-4-phenylbutan-2-one
Reaction equation
[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH3:6].[CH3:30][CH2:31][O:32][C:33](=[O:34])[CH3:35].[OH:18][CH:19]([CH2:20][c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[C:27](=[O:28])[CH3:29].[c:7]1([CH2:13][CH2:14][C:15]([CH3:16])=[O:17])[cH:8][cH:9][cH:10][cH:11][cH:12]1>>[c:7]1([CH2:13][CH2:14][C:15]([CH2:16][OH:18])=[O:17])[cH:8][cH:9][cH:10][cH:11][cH:12]1Participants
5
Sources & evidence
- ORD record
- ord-1891f8fe2ca64663ae7c693d9a4ad560
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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