Ethanol → 5-(4-Trifluoromethyl-benzyl)-10,11-dihydro-5H-dibenzo[a,d]cycloheptene
반응식
[CH3:27][CH2:28][O:29][C:30](=[O:31])[CH3:32].[CH3:35][CH2:36][OH:37].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH:7]=[C:8]2[c:9]3[c:10]([cH:19][cH:20][cH:21][cH:22]3)[CH2:11][CH2:12][c:13]3[c:14]2[cH:15][cH:16][cH:17][cH:18]3)[cH:23][cH:24]1)([F:25])[F:26].[H:33][H:34]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH2:7][CH:8]2[c:9]3[c:10]([cH:19][cH:20][cH:21][cH:22]3)[CH2:11][CH2:12][c:13]3[c:14]2[cH:15][cH:16][cH:17][cH:18]3)[cH:23][cH:24]1)([F:25])[F:26]참가 물질
5
출처 및 근거
- ORD 기록
- ord-afe16084ec6a4b8facb81e54caa8d5d3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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