Acetic Acid → 3-(4-Nitrophenyl)propan-1-amine
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[BH4-:15].[CH3:17][C:18](=[O:19])[OH:20].[CH3:21][OH:22].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([CH2:10][CH2:11][C:12](=[O:13])[NH2:14])[cH:8][cH:9]1.[Na+:16].[O:23]1[CH2:24][CH2:25][O:26][CH2:27][CH2:28]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([CH2:10][CH2:11][CH2:12][NH2:14])[cH:8][cH:9]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-3e2075464d74471b818358c11810fbb7
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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