Acetonitrile → Ethyl 2-(4-acetyl-2-methylphenoxy)acetate
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[Br:12][CH2:13][C:14](=[O:15])[O:16][CH2:17][CH3:18].[C:19](=[O:20])([O-:21])[O-:22].[CH3:25][C:26]#[N:27].[Cs+:23].[Cs+:24].[OH:1][c:2]1[c:3]([CH3:11])[cH:4][c:5]([C:8]([CH3:9])=[O:10])[cH:6][cH:7]1>>[O:1]([c:2]1[c:3]([CH3:11])[cH:4][c:5]([C:8]([CH3:9])=[O:10])[cH:6][cH:7]1)[CH2:13][C:14](=[O:15])[O:16][CH2:17][CH3:18]참가 물질
6
출처 및 근거
- ORD 기록
- ord-31d1df4980f94ccd8cdfc76f253c9438
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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