1-Chloro-3-phenoxypropan-2-one → Chloride
반응식
[CH2:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[NH+:20]1[C:21](=[S:26])[N:22]([CH3:25])[CH:23]=[CH:24]1.[Cl:1][CH2:2][C:3]([CH2:4][O:5][c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)=[O:12]>>[CH2:2]([C:3]([CH2:4][O:5][c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)=[O:12])[S:26][CH:21]1[NH+:20]([CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[CH:24]=[CH:23][N:22]1[CH3:25].[Cl-:1]참가 물질
4
출처 및 근거
- ORD 기록
- ord-3f46d73c6f71455380eb6dd16bb63c3d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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