Toluene → HCID 22258262, 화합물
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[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[c:9]1[c:10]2[n:11]([c:12](=[O:15])[cH:13][cH:14]1)[cH:16][cH:17][nH:18]2.[CH3:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1.[P:19]([Cl:20])([Cl:21])([Cl:22])=[O:23]>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[c:9]1[c:10]2[n:11]([c:12]([Cl:21])[cH:13][cH:14]1)[cH:16][cH:17][n:18]2참가 물질
4
출처 및 근거
- ORD 기록
- ord-d0c690a135174ee5943784ef9a9530b1
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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