Hexane → 3,3-Dimethyl-1-(4-methylphenyl)butan-1-one
반응식
[CH3:15][CH2:16][CH2:17][CH2:18][CH2:19][CH3:20].[CH3:1][C:2]([CH2:3][CH:4]([OH:5])[c:6]1[cH:7][cH:8][c:9]([CH3:12])[cH:10][cH:11]1)([CH3:13])[CH3:14]>>[CH3:1][C:2]([CH2:3][C:4](=[O:5])[c:6]1[cH:7][cH:8][c:9]([CH3:12])[cH:10][cH:11]1)([CH3:13])[CH3:14]참가 물질
3
출처 및 근거
- ORD 기록
- ord-4edb376785974fc0851ba91ba34a3825
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
반응 노트
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