Hexane → 1-[4-(Diethoxymethyl)-phenyl]-3,3-dimethylbutan-1-one
Reaction equation
[CH2:1]([CH3:2])[O:3][CH:4]([c:5]1[cH:6][cH:7][c:8]([CH:11]([CH2:12][C:13]([CH3:14])([CH3:15])[CH3:16])[OH:17])[cH:9][cH:10]1)[O:18][CH2:19][CH3:20].[CH3:21][CH2:22][CH2:23][CH2:24][CH2:25][CH3:26]>>[CH2:1]([CH3:2])[O:3][CH:4]([c:5]1[cH:6][cH:7][c:8]([C:11]([CH2:12][C:13]([CH3:14])([CH3:15])[CH3:16])=[O:17])[cH:9][cH:10]1)[O:18][CH2:19][CH3:20]Participants
3
Sources & evidence
- ORD record
- ord-afe916e2f61e4c79871e980cb3630f74
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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