Acetone → HCID 22490903, 화합물
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[Br:1][c:2]1[c:3]([OH:14])[cH:4][c:5]2[c:10]([cH:11]1)[CH2:9][CH2:8][CH2:7][C:6]2([CH3:12])[CH3:13].[C:18](=[O:19])([O-:20])[O-:21].[CH3:24][C:25](=[O:26])[CH3:27].[I:15][CH2:16][CH3:17].[K+:22].[K+:23]>>[Br:1][c:2]1[c:3]([O:14][CH2:16][CH3:17])[cH:4][c:5]2[c:10]([cH:11]1)[CH2:9][CH2:8][CH2:7][C:6]2([CH3:12])[CH3:13]참가 물질
6
출처 및 근거
- ORD 기록
- ord-73042c8caad748fd84414be9499ffc55
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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