Ammonia → Benzonitrile, 3-(aminomethyl)-
반응식
[C:13]([c:14]1[cH:15][c:16]([C:20]([NH2:21])=[O:22])[cH:17][cH:18][cH:19]1)#[N:23].[C:24]([c:25]1[cH:26][c:27]([C:31]([OH:32])=[O:33])[cH:28][cH:29][cH:30]1)#[N:34].[H:1][H:2].[N:3]#[C:4][c:5]1[cH:6][cH:7][cH:8][c:9]([C:11]#[N:12])[cH:10]1.[NH3:35].[Na+:37].[OH-:36].[Pd:38]>>[N:3]#[C:4][c:5]1[cH:6][cH:7][cH:8][c:9]([CH2:11][NH2:12])[cH:10]1참가 물질
9
출처 및 근거
- ORD 기록
- ord-231b117b0fc84db09f1339674eccd271
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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