Benzene → 6-(2-Chloroethyl)-1,3,3-trimethylbicyclo[2.2.2]octan-2-one
반응식
[CH3:1][C:2]12[C:3](=[O:15])[C:4]([CH3:13])([CH3:14])[CH:5]([CH2:6][CH:7]1[CH2:8][CH2:9][OH:10])[CH2:11][CH2:12]2.[ClH:20].[S:16]([Cl:17])([Cl:18])=[O:19].[cH:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1>>[CH3:1][C:2]12[C:3](=[O:15])[C:4]([CH3:13])([CH3:14])[CH:5]([CH2:6][CH:7]1[CH2:8][CH2:9][Cl:18])[CH2:11][CH2:12]2참가 물질
5
출처 및 근거
- ORD 기록
- ord-9c8ea42e3b284192b530442510c81997
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
반응 노트
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