Tert-Butyl nitrite → HCID 21998165, 화합물
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[CH3:24][S:25][S:26][CH3:27].[N:28]([O:29][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:34].[NH2:1][c:2]1[s:3][c:4]2[c:5]([n:6]1)[c:7]([Cl:23])[cH:8][c:9]([F:22])[c:10]2-[c:11]1[n:12][n:13]([CH3:21])[c:14]([C:17]([F:18])([F:19])[F:20])[c:15]1[Cl:16]>>[c:2]1([S:25][CH3:24])[s:3][c:4]2[c:5]([n:6]1)[c:7]([Cl:23])[cH:8][c:9]([F:22])[c:10]2-[c:11]1[n:12][n:13]([CH3:21])[c:14]([C:17]([F:18])([F:19])[F:20])[c:15]1[Cl:16]참가 물질
4
출처 및 근거
- ORD 기록
- ord-9793fb564c8d42c690c8b1e2dd2762cc
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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