Water → 3-Methylcyclopentyl 4-methylbenzene-1-sulfonate
반응식
[CH3:1][CH:2]1[CH2:3][CH:4]([OH:7])[CH2:5][CH2:6]1.[OH2:25].[c:8]1([CH3:18])[cH:9][cH:10][c:11]([S:14](=[O:15])(=[O:16])[Cl:17])[cH:12][cH:13]1.[cH:19]1[cH:20][cH:21][n:22][cH:23][cH:24]1>>[CH3:1][CH:2]1[CH2:3][CH:4]([O:7][S:14]([c:11]2[cH:10][cH:9][c:8]([CH3:18])[cH:13][cH:12]2)(=[O:15])=[O:16])[CH2:5][CH2:6]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-88da5cb84cd94772961ab7b4a1dbead4
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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