Acetonitrile → HCID 69072849, 화합물
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[C:1](=[O:2])([OH:3])[CH2:4][O:5][CH2:6][C:7](=[O:8])[N:9]([c:10]1[cH:11][c:12]2[c:13]([n+:14]([CH2:18][CH2:19][CH2:20][S:21]([O-:22])(=[O:23])=[O:24])[c:15]([CH3:17])[s:16]2)[cH:25][cH:26]1)[CH3:27].[CH3:28][C:29]#[N:30]>>[C:1](=[O:2])([OH:3])[CH2:4][O:5][CH2:6][C:7](=[O:8])[N:9]([c:10]1[cH:11][c:12]2[c:13]([n:14][c:15]([CH3:17])[s:16]2)[cH:25][cH:26]1)[CH3:27]참가 물질
3
출처 및 근거
- ORD 기록
- ord-082c1e3e3da64ef98d13ef64ce577e3c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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