반응식
[Br-:17].[O:26]1[CH2:27][CH2:28][CH2:29][CH2:30]1.[c:18]1([CH3:25])[c:19]([Mg+:24])[cH:20][cH:21][cH:22][cH:23]1.[c:1]1([CH:11]=[C:12]([C:13]#[N:14])[C:15]#[N:16])[cH:2][cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12>>[c:1]1([CH:11]([CH:12]([C:13]#[N:14])[C:15]#[N:16])[c:19]2[c:18]([CH3:25])[cH:23][cH:22][cH:21][cH:20]2)[cH:2][cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12참가 물질
5
출처 및 근거
- ORD 기록
- ord-f306f6a33f5b4839a40bf2db89193475
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
연결된 노트
불러오는 중…