Potassium Cation → 3-Cyanomethyl-4-iodo-benzonitrile
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[I-:18].[K+:17].[N:1]([O-:2])=[O:3].[NH2:5][c:6]1[c:7]([CH2:14][C:15]#[N:16])[cH:8][c:9]([C:10]#[N:11])[cH:12][cH:13]1.[Na+:24].[Na+:25].[Na+:4].[OH2:26].[S:19]([O-:20])([O-:21])(=[O:22])=[S:23].[S:27](=[O:28])(=[O:29])([OH:30])[OH:31]>>[c:6]1([I:18])[c:7]([CH2:14][C:15]#[N:16])[cH:8][c:9]([C:10]#[N:11])[cH:12][cH:13]1참가 물질
9
출처 및 근거
- ORD 기록
- ord-6c9a222fac064cd9924e7eafd71b72e2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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