Acetonitrile → 3-(3-(2-Ethyl-2-hydroxybutoxy)phenyl)-3-hydroxypropanenitrile
반응식
[CH2:1]([CH3:2])[C:3]([CH2:4][O:5][c:6]1[cH:7][c:8]([CH:9]=[O:10])[cH:11][cH:12][cH:13]1)([CH2:14][CH3:15])[OH:16].[CH3:17][C:18]#[N:19]>>[CH2:1]([CH3:2])[C:3]([CH2:4][O:5][c:6]1[cH:7][c:8]([CH:9]([OH:10])[CH2:17][C:18]#[N:19])[cH:11][cH:12][cH:13]1)([CH2:14][CH3:15])[OH:16]참가 물질
3
출처 및 근거
- ORD 기록
- ord-461e6c37227148e28cea3e6dfbd04134
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
반응 노트
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