Toluene → HCID 57548171, 화합물
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[CH2:9]([O:10][C:12](=[O:11])[CH2:13][CH2:14][c:15]1[cH:16][cH:17][c:18]([Cl:21])[cH:19][cH:20]1)[CH3:22].[CH3:1][Al:2]([CH3:3])[CH3:4].[CH3:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[NH2:5][CH2:6][CH2:7][NH2:8]>>[NH:5]1[CH2:6][CH2:7][N:8]=[C:12]1[CH2:13][CH2:14][c:15]1[cH:16][cH:17][c:18]([Cl:21])[cH:19][cH:20]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-fcc681defeb745cd82c553b462ac1fcf
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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