Isopropyl trifluoromethanesulfonate → HCID 54017818, 화합물
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[Cl:1][c:2]1[c:3]([C:9]([CH2:10][n:11]2[n:12][n:13][n:14][cH:15]2)=[O:16])[cH:4][cH:5][c:6]([Cl:8])[cH:7]1.[S:17]([O:18][CH:25]([CH3:26])[CH3:27])([C:19]([F:20])([F:21])[F:22])(=[O:23])=[O:24]>>[Cl:1][c:2]1[c:3]([C:9](=[CH:10][n:11]2[n:12][n:13][n:14][cH:15]2)[O:16][CH:25]([CH3:26])[CH3:27])[cH:4][cH:5][c:6]([Cl:8])[cH:7]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-d4971384f32748dbb839102fc4acc43f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
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