Acetone → 4-(2-Hydroxy-2-methylpropoxy)-4-methylcyclohexanone
반응식
[CH3:19][C:20](=[O:21])[CH3:22].[CH3:1][C:2]([CH2:3][O:4][C:5]1([CH3:15])[CH2:6][CH2:7][C:8]2([O:9][CH2:12][CH2:11][O:10]2)[CH2:13][CH2:14]1)([CH3:16])[OH:17].[ClH:18].[OH2:23]>>[CH3:1][C:2]([CH2:3][O:4][C:5]1([CH3:15])[CH2:6][CH2:7][C:8](=[O:9])[CH2:13][CH2:14]1)([CH3:16])[OH:17]참가 물질
5
출처 및 근거
- ORD 기록
- ord-c5a7972b8a19416e86e66ed7a839ed99
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
반응 노트
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