Water → 4-Fluoro-5-formyl-2-methoxybenzonitrile
반응식
[Br:1][c:2]1[c:3]([O:11][CH3:12])[cH:4][c:5]([F:10])[c:6]([CH:7]=[O:8])[cH:9]1.[CH3:19][N:20]1[CH2:21][CH2:22][CH2:23][C:24]1=[O:25].[Cu:13]([C:14]#[N:15])[C:16]#[N:17].[OH2:18]>>[c:2]1([C:14]#[N:15])[c:3]([O:11][CH3:12])[cH:4][c:5]([F:10])[c:6]([CH:7]=[O:8])[cH:9]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-73742349ac0b4ef6a63ad602a662777e
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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