Chloride → HCID 13363395, 화합물
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[Al+3:9].[Br:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1.[C:12]([CH3:13])(=[O:14])[N:15]1[CH2:16][CH2:17][CH:18]([C:21](=[O:22])[Cl:23])[CH2:19][CH2:20]1.[Cl-:10].[Cl-:11].[Cl-:8].[ClH:24]>>[Br:1][c:2]1[cH:3][cH:4][c:5]([C:21]([CH:18]2[CH2:17][CH2:16][N:15]([C:12]([CH3:13])=[O:14])[CH2:20][CH2:19]2)=[O:22])[cH:6][cH:7]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-bf991280280e41499cb480d271e86d0c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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