Acetonitrile → HCID 18387738, 화합물
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[CH3:13][CH2:14][N:15]([CH2:16][CH3:17])[CH2:18][CH3:19].[CH3:20][S:21](=[O:22])(=[O:23])[Cl:24].[CH3:25][C:26]#[N:27].[s:1]1[c:2](-[c:6]2[cH:7][cH:8][c:9]([OH:12])[cH:10][cH:11]2)[cH:3][cH:4][cH:5]1>>[s:1]1[c:2](-[c:6]2[cH:7][cH:8][c:9]([O:12][S:21]([CH3:20])(=[O:22])=[O:23])[cH:10][cH:11]2)[cH:3][cH:4][cH:5]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-84305282d7c340afa4bacf8556e9fb55
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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