2,2,2-Trifluoroethanol → HCID 57693559, 화합물
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[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[cH:9][cH:10][c:11]2[c:12]1[n:13][c:14]([NH2:18])[n:15][c:16]2[Cl:17].[CH3:19][c:20]1[c:21]([NH2:22])[c:23]([CH3:28])[cH:24][c:25]([CH3:27])[cH:26]1.[OH:29][C:30]([C:31]([F:32])([F:33])[F:34])=[O:35].[OH:36][CH2:37][C:38]([F:39])([F:40])[F:41]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[cH:9][cH:10][c:11]2[c:12]1[n:13][c:14]([NH2:18])[n:15][c:16]2[NH:22][c:21]1[c:20]([CH3:19])[cH:26][c:25]([CH3:27])[cH:24][c:23]1[CH3:28]참가 물질
5
출처 및 근거
- ORD 기록
- ord-537a2f2220b64915800681150c00819e
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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