Benzaldehyde → 2-Nitro-1-phenylbutan-1-ol
반응식
[CH2:16]([Al+2:17])[CH3:18].[CH3:7][CH2:8][N:9]([CH2:10][CH3:11])[CH2:12][CH3:13].[CH:19](=[O:20])[c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1.[Cl-:14].[Cl-:15].[Cl:27][CH2:28][Cl:29].[N+:1](=[O:2])([O-:3])[CH2:4][CH2:5][CH3:6]>>[N+:1](=[O:2])([O-:3])[CH:4]([CH2:5][CH3:6])[CH:19]([OH:20])[c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-951ea052d19c43a59df8d10bd704d1e9
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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