Ethanol → HCID 12853039, 화합물
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[CH3:23][CH2:24][OH:25].[F:1][c:2]1[c:3]([CH:8]2[CH:9]([C:16]([O:17][CH2:18][CH3:19])=[O:20])[C:10]([CH3:15])=[CH:11][C:12](=[O:14])[CH2:13]2)[cH:4][cH:5][cH:6][cH:7]1.[Na+:22].[OH-:21].[OH2:26]>>[F:1][c:2]1[c:3]([CH:8]2[CH2:9][C:10]([CH3:15])=[CH:11][C:12](=[O:14])[CH2:13]2)[cH:4][cH:5][cH:6][cH:7]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-bd09ae12a4164045a77f50c19f59e3c5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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