Acetonitrile → HCID 66624065, 화합물
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[CH3:30][C:31]#[N:32].[F:19][c:20]1[c:21]([CH:22]=[O:23])[cH:24][cH:25][c:26]([OH:29])[c:27]1[F:28].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[cH:10][cH:11][c:12]([C:14]([CH3:15])=[O:16])[s:13]2)[cH:7][cH:8]1)([F:17])[F:18]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[cH:10][cH:11][c:12]([C:14]([CH:15]=[CH:22][c:21]3[c:20]([F:19])[c:27]([F:28])[c:26]([OH:29])[cH:25][cH:24]3)=[O:16])[s:13]2)[cH:7][cH:8]1)([F:17])[F:18]참가 물질
4
출처 및 근거
- ORD 기록
- ord-40820b7bacea46d9a443683afdcf7e02
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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