Carbon Tetrachloride → 2-(4-Trifluoromethylbenzoyl)-3-chloro-5-methylbenzyl azide
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[Br:22][N:23]1[C:24](=[O:25])[CH2:26][CH2:27][C:28]1=[O:29].[C:30]([O:31][O:32][C:33](=[O:34])[c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)(=[O:41])[c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[C:59]([Cl:60])([Cl:61])([Cl:62])[Cl:63].[CH3:51][N:52]=[C:53]([NH2:54])[N+:55]([CH3:56])([CH3:57])[CH3:58].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([C:7](=[O:8])[c:9]2[c:10]([Cl:17])[cH:11][c:12]([CH3:16])[cH:13][c:14]2[CH3:15])[cH:18][cH:19]1)([F:20])[F:21].[N-:48]=[N+:49]=[N-:50]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([C:7](=[O:8])[c:9]2[c:10]([Cl:17])[cH:11][c:12]([CH3:16])[cH:13][c:14]2[CH2:15][N:48]=[N+:49]=[N-:50])[cH:18][cH:19]1)([F:20])[F:21]참가 물질
7
출처 및 근거
- ORD 기록
- ord-b08f0aec261e421e974c819b7879fc00
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
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