Acetate → 1,1,3,4,4,6-Hexamethyltetralin
반응식
[C:21]([O-:22])(=[O:23])[CH3:24].[C:26].[CH:28]([OH:29])([CH3:30])[CH3:31].[Cl:1][CH2:2][CH:3]1[CH2:4][C:5]([CH3:16])([CH3:17])[c:6]2[cH:7][cH:8][c:9]([CH3:15])[cH:10][c:11]2[C:12]1([CH3:13])[CH3:14].[Na+:25].[OH2:18].[OH2:19].[OH2:20].[Pd:27]>>[CH3:2][CH:3]1[CH2:4][C:5]([CH3:16])([CH3:17])[c:6]2[cH:7][cH:8][c:9]([CH3:15])[cH:10][c:11]2[C:12]1([CH3:13])[CH3:14]참가 물질
8
출처 및 근거
- ORD 기록
- ord-e322929c7ef24d138f83633c940e999a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
반응 노트
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