Methanol → HCID 15908145, 화합물
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[CH3:15][NH2:16].[CH3:23][OH:24].[Cl:1][c:2]1[n:3][c:4]([Cl:14])[c:5]2[c:6]([n:7]1)[c:8]([CH:11]([CH3:12])[CH3:13])[cH:9][s:10]2.[O:18]=[CH:19][N:20]([CH3:21])[CH3:22].[OH2:17]>>[Cl:1][c:2]1[n:3][c:4]([NH:16][CH3:15])[c:5]2[c:6]([n:7]1)[c:8]([CH:11]([CH3:12])[CH3:13])[cH:9][s:10]2참가 물질
6
출처 및 근거
- ORD 기록
- ord-44add305198244fd9f08a980f4666a90
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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