Acetonitrile → HCID 68839933, 화합물
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[CH2:1]([CH3:2])[CH:3]([CH2:4][CH3:5])[c:6]1[c:7]2[n:8]([n:9][c:10]([CH3:12])[cH:11]1)[c:13](-[c:17]1[s:18][cH:19][cH:20][c:21]1[O:22][CH3:23])[c:14]([CH3:16])[n:15]2.[CH3:32][C:33]#[N:34].[O:24]=[C:25]1[N:26]([I:31])[C:27](=[O:28])[CH2:29][CH2:30]1>>[CH2:1]([CH3:2])[CH:3]([CH2:4][CH3:5])[c:6]1[c:7]2[n:8]([n:9][c:10]([CH3:12])[cH:11]1)[c:13](-[c:17]1[s:18][c:19]([I:31])[cH:20][c:21]1[O:22][CH3:23])[c:14]([CH3:16])[n:15]2참가 물질
4
출처 및 근거
- ORD 기록
- ord-d674dcccf5d344f7919b934927be3c8a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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