Chloride → 3-Methyl-1-(4-methylphenyl)butan-1-one
반응식
[Al+3:11].[C:1]([CH2:2][CH:3]([CH3:4])[CH3:5])(=[O:6])[Cl:7].[CH3:13][c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1.[Cl-:10].[Cl-:8].[Cl-:9].[OH2:12]>>[C:1]([CH2:2][CH:3]([CH3:4])[CH3:5])(=[O:6])[c:17]1[cH:16][cH:15][c:14]([CH3:13])[cH:19][cH:18]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-cdce8c3c46d246ad9ecb57bed1cbf412
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
반응 노트
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