반응식
[CH2:3]([C:4]#[C:5][CH3:6])[OH:7].[Cl-:24].[Cl:8][c:9]1[n:10][cH:11][n:12][c:13]([CH2:15][c:16]2[c:17]([F:23])[c:18]([F:22])[cH:19][cH:20][cH:21]2)[cH:14]1.[H-:1].[NH4+:25].[Na+:2].[O:26]1[CH2:27][CH2:28][CH2:29][CH2:30]1>>[CH2:3]([C:4]#[C:5][CH3:6])[O:7][c:9]1[n:10][cH:11][n:12][c:13]([CH2:15][c:16]2[c:17]([F:23])[c:18]([F:22])[cH:19][cH:20][cH:21]2)[cH:14]1참가 물질
8
출처 및 근거
- ORD 기록
- ord-179f911bfb084905bb139f1261a07b72
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
연결된 노트
불러오는 중…