Acetonitrile → HCID 178473018, 화합물
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[Br:7][CH2:8][c:9]1[cH:10][cH:11][cH:12][c:13]2[cH:14][n:15](-[c:18]3[cH:19][cH:20][c:21]([C:24]([F:25])([F:26])[F:27])[cH:22][cH:23]3)[n:16][c:17]12.[C:1](=[O:2])([O-:3])[O-:4].[CH3:43][C:44]#[N:45].[Cs+:5].[Cs+:6].[SH:28][c:29]1[cH:30][c:31]([CH3:42])[c:32]([O:33][CH2:34][C:35](=[O:36])[O:37][CH2:38][CH3:39])[cH:40][cH:41]1>>[CH3:1][SH:28]([c:9]1[cH:10][cH:11][cH:12][c:13]2[cH:14][n:15](-[c:18]3[cH:19][cH:20][c:21]([C:24]([F:25])([F:26])[F:27])[cH:22][cH:23]3)[n:16][c:17]12)[c:29]1[cH:30][c:31]([CH3:42])[c:32]([O:33][CH2:34][C:35](=[O:36])[O:37][CH2:38][CH3:39])[cH:40][cH:41]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-cbfb1e65bcdf403ebb19dcfb03681fcb
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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