Ethyl Acetate → HCID 86628983, 화합물
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[CH3:28][CH2:29][O:30][C:31](=[O:32])[CH3:33].[OH:17][O:18][C:19]([c:20]1[cH:21][c:22]([Cl:23])[cH:24][cH:25][cH:26]1)=[O:27].[n:1]1[cH:2][cH:3][c:4]([CH2:7][CH2:8][NH:9][C:10]([O:11][C:12]([CH3:13])([CH3:14])[CH3:15])=[O:16])[cH:5][cH:6]1>>[n:1]1[cH:2][cH:3][c:4]([CH2:7][CH2:8][NH+:9]([C:10]([O:11][C:12]([CH3:13])([CH3:14])[CH3:15])=[O:16])[O-:17])[cH:5][cH:6]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-e461a963e2a8457cacc5db022e7e5087
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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