Bicarbonate Ion → 2,3-Dichloro-4-fluoroaniline
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[C:1]([O:2][C:3](=[O:4])[NH:7][c:8]1[c:9]([Cl:16])[c:10]([Cl:15])[c:11]([F:14])[cH:12][cH:13]1)([CH3:5])([CH3:6])[CH3:17].[C:25](=[O:26])([OH:27])[O-:28].[Cl:30][CH2:31][Cl:32].[Na+:29].[OH:18][C:19]([C:20]([F:21])([F:22])[F:23])=[O:24]>>[NH2:7][c:8]1[c:9]([Cl:16])[c:10]([Cl:15])[c:11]([F:14])[cH:12][cH:13]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-fba81186d2d547b0aeb113092cb7e712
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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