반응식
[Br:1][C:2]1=[C:3]([c:7]2[cH:8][cH:9][c:10]([S:13][CH3:14])[cH:11][cH:12]2)[CH2:4][CH2:5][CH2:6]1.[F:15][c:16]1[cH:17][c:18]([CH3:25])[c:19]([B:22]([OH:23])[OH:24])[cH:20][cH:21]1>>[C:2]1([c:19]2[c:18]([CH3:25])[cH:17][c:16]([F:15])[cH:21][cH:20]2)=[C:3]([c:7]2[cH:8][cH:9][c:10]([S:13][CH3:14])[cH:11][cH:12]2)[CH2:4][CH2:5][CH2:6]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-977f38fbbb1649e9ae9568687eec3e56
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…