Toluene → HCID 13246037, 화합물
반응식
[CH3:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1.[Cl:1][c:2]1[cH:3][c:4]([N+:21]([O-:22])=[O:23])[cH:5][c:6]([Cl:20])[c:7]1[O:8][c:9]1[cH:10][cH:11][cH:12][c:13]2[c:17]1[O:16][C:15]([CH3:18])([CH3:19])[CH2:14]2>>[Cl:1][c:2]1[cH:3][c:4]([NH2:21])[cH:5][c:6]([Cl:20])[c:7]1[O:8][c:9]1[cH:10][cH:11][cH:12][c:13]2[c:17]1[O:16][C:15]([CH3:18])([CH3:19])[CH2:14]2참가 물질
3
출처 및 근거
- ORD 기록
- ord-3e8650cbcc9c472ba0cc09271a04133c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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