Ethyl Acetate → 2-(3-Ethoxy-but-3-enyl)-5-hydroxy-benzonitrile
반응식
[CH2:1]([CH3:2])[O:3][C:4]([CH:5]=[CH:6][c:7]1[c:8]([C:9]#[N:10])[cH:11][c:12]([OH:15])[cH:13][cH:14]1)=[CH2:16].[CH3:19][CH2:20][O:21][C:22]([CH3:23])=[O:24].[H:17][H:18]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][c:7]1[c:8]([C:9]#[N:10])[cH:11][c:12]([OH:15])[cH:13][cH:14]1)=[CH2:16]참가 물질
4
출처 및 근거
- ORD 기록
- ord-6cde5173cfca4e4cba95ae9214b8ecc1
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
반응 노트
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