Ethanol → HCID 54141100, 화합물
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[CH3:19][CH2:20][OH:21].[Cl:3][c:4]1[c:5]([C:16](=[CH2:17])[CH3:18])[c:6]([S:14][CH3:15])[c:7]([C:8](=[O:9])[O:10][CH3:11])[cH:12][cH:13]1.[Na+:2].[OH-:1].[OH2:22]>>[Cl:3][c:4]1[c:5]([C:16](=[CH2:17])[CH3:18])[c:6]([S:14][CH3:15])[c:7]([C:8](=[O:9])[OH:10])[cH:12][cH:13]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-cbc1025e97864b08b066fb4f9f1f365a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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