1-Butanol → HCID 66995898, 화합물
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[CH2:18]([N:19]([CH:20]([CH3:21])[CH3:22])[CH:23]([CH3:24])[CH3:25])[CH3:26].[CH2:27]([OH:28])[CH2:29][CH2:30][CH3:31].[Cl:8][c:9]1[cH:10][cH:11][n:12][c:13]2[n:14]1[n:15][cH:16][n:17]2.[NH:1]1[CH:2]([CH2:3][OH:4])[CH2:5][CH2:6][CH2:7]1>>[N:1]1([c:9]2[cH:10][cH:11][n:12][c:13]3[n:14]2[n:15][cH:16][n:17]3)[CH:2]([CH2:3][OH:4])[CH2:5][CH2:6][CH2:7]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-a9bbaac529624c8d98069963476f287a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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