Ethanol → HCID 67289282, 화합물
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[CH3:21][CH2:22][OH:23].[N+:10](=[O:11])([O-:12])[c:13]1[cH:14][c:15]([CH:16]=[O:17])[cH:18][cH:19][cH:20]1.[NH2:1][c:2]1[cH:3][cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1>>[N:1]([c:2]1[cH:3][cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1)=[CH:16][c:15]1[cH:14][c:13]([N+:10](=[O:11])[O-:12])[cH:20][cH:19][cH:18]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-45f2c12389ea45ddb175c9f2e8adfa7e
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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