Benzene → 4-Cyclobutyl-3-buten-2-one
반응식
[CH:2]1([C:6]([OH:7])=[O:8])[CH2:3][CH2:4][CH2:5]1.[Cl-:1].[O:38]1[CH2:39][CH2:40][CH2:41][CH2:42]1.[c:9]1([P:10]([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)([c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)=[CH:28][C:29]([CH3:30])=[O:31])[cH:23][cH:24][cH:25][cH:26][cH:27]1.[cH:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1>>[CH:2]1([CH:6]=[CH:28][C:29]([CH3:30])=[O:31])[CH2:3][CH2:4][CH2:5]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-52e08bcc938e46098e00b1f6c1b175fa
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
반응 노트
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