Potassium Cation → Methyl 3-chloro-2-methylbenzoate
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[C:14](=[O:15])([O-:16])[O-:17].[CH3:20][N:21]([CH3:22])[CH:23]=[O:24].[CH3:25][CH2:26][O:27][C:28](=[O:29])[CH3:30].[Cl:3][c:4]1[c:5]([CH3:13])[c:6]([C:7](=[O:8])[OH:9])[cH:10][cH:11][cH:12]1.[I:1][CH3:2].[K+:18].[K+:19].[OH2:31]>>[Cl:3][c:4]1[c:5]([CH3:13])[c:6]([C:7](=[O:8])[O:9][CH3:14])[cH:10][cH:11][cH:12]1참가 물질
8
출처 및 근거
- ORD 기록
- ord-029779fac1da44d69783fc25fda62f27
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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