Ethyl Acetate → HCID 66958566, 화합물
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[CH3:26][CH2:27][O:28][C:29](=[O:30])[CH3:31].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][n:6][c:7]2[cH:8][cH:9][cH:10][n:11][c:12]2[c:13]1[NH:14][CH2:15][CH2:16][CH2:17][NH:18][C:19]([O:20][C:21]([CH3:22])([CH3:23])[CH3:24])=[O:25]>>[NH2:1][c:4]1[cH:5][n:6][c:7]2[cH:8][cH:9][cH:10][n:11][c:12]2[c:13]1[NH:14][CH2:15][CH2:16][CH2:17][NH:18][C:19]([O:20][C:21]([CH3:22])([CH3:23])[CH3:24])=[O:25]참가 물질
3
출처 및 근거
- ORD 기록
- ord-273bfb4d00c742b688203b56381e68c5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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