Acetonitrile → HCID 67316482, 화합물
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[CH3:19][C:20]#[N:21].[CH3:1][O:2][c:3]1[c:4]([CH2:5][O:6][c:7]2[cH:8][c:9]([CH:10]=[O:11])[cH:12][cH:13][cH:14]2)[cH:15][cH:16][cH:17][cH:18]1>>[CH3:1][O:2][c:3]1[c:4]([CH2:5][O:6][c:7]2[cH:8][c:9]([CH:10]([OH:11])[CH2:19][C:20]#[N:21])[cH:12][cH:13][cH:14]2)[cH:15][cH:16][cH:17][cH:18]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-dcf6189afe214da591b77591acf7e19c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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