Chloride → Methyl {4-[4-(2-bromo-2-methylpropanoyl)phenyl]bicyclo[2.2.2]oct-1-yl}acetate
반응식
[Al+3:41].[Br:44][C:45]([C:46](=[O:47])[Br:48])([CH3:49])[CH3:50].[Cl-:40].[Cl-:42].[Cl-:43].[Cl:51][CH2:52][Cl:53].[OH2:54].[c:1]1([C:7]23[CH2:8][CH2:9][C:10]([CH2:15][C:16](=[O:17])[O:18][CH3:19])([CH2:11][CH2:12]2)[CH2:13][CH2:14]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[c:20]1([C:21]23[CH2:22][CH2:23][C:24]([CH:25]([CH3:26])[C:27]([O:28][CH3:29])=[O:30])([CH2:31][CH2:32]2)[CH2:33][CH2:34]3)[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[c:1]1([C:7]23[CH2:8][CH2:9][C:10]([CH2:15][C:16](=[O:17])[O:18][CH3:19])([CH2:11][CH2:12]2)[CH2:13][CH2:14]3)[cH:2][cH:3][c:4]([C:46]([C:45]([Br:44])([CH3:49])[CH3:50])=[O:47])[cH:5][cH:6]1참가 물질
8
반응물 7
생성물 1
출처 및 근거
- ORD 기록
- ord-d2629bc7b72746eab3bd38d18e457ed4
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
반응 노트
불러오는 중…