Acetone → HCID 21319892, 화합물
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[Br:1][CH2:2][c:3]1[cH:4][cH:5][c:6]2[c:7]([c:8](-[c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[c:9]([N+:11](=[O:12])[O-:13])[o:10]2)[cH:20]1.[CH3:21][C:22](=[O:23])[CH3:24].[CH3:25][CH2:26][OH:27].[Na:28][C:29]#[N:30].[OH2:31]>>[CH2:2]([c:3]1[cH:4][cH:5][c:6]2[c:7]([c:8](-[c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[c:9]([N+:11](=[O:12])[O-:13])[o:10]2)[cH:20]1)[C:29]#[N:30]참가 물질
6
출처 및 근거
- ORD 기록
- ord-a1632a00e8244c669349f2ff076be076
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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