2,2-Dimethyl-3-oxobutanenitrile → HCID 69140201, 화합물
반응식
[CH3:1][C:2]([C:3]#[N:4])([C:5]([CH3:6])=[O:7])[CH3:8].[Cl:9][c:10]1[c:11]([O:18][CH3:19])[cH:12][c:13]([CH:14]=[O:15])[cH:16][cH:17]1>>[CH3:1][C:2]([C:3]#[N:4])([C:5]([CH:6]=[CH:14][c:13]1[cH:12][c:11]([O:18][CH3:19])[c:10]([Cl:9])[cH:17][cH:16]1)=[O:7])[CH3:8]참가 물질
3
출처 및 근거
- ORD 기록
- ord-8001511091a349b9a57d28ae5b73332e
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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