Acetic Acid → 1-(3-Fluoro-4-(methylsulfonyl)phenyl)propan-2-one
반응식
[CH3:19][C:20](=[O:21])[OH:22].[F:1][c:2]1[c:3]([S:14](=[O:15])(=[O:16])[CH3:17])[cH:4][cH:5][c:6]([CH:8]=[C:9]([CH3:10])[N+:11]([O-:12])=[O:13])[cH:7]1.[Fe:23].[OH2:18]>>[F:1][c:2]1[c:3]([S:14](=[O:15])(=[O:16])[CH3:17])[cH:4][cH:5][c:6]([CH2:8][C:9]([CH3:10])=[O:18])[cH:7]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-9802ecf99a674c049f61fa07a7798e28
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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