Water → Cyclohexanone, 2-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]-

HRID 119885

반응식

HRID 119885 반응식
[CH3:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[F:12][C:13]([c:14]1[cH:15][c:16]([C:17]([CH2:18][Br:19])=[O:20])[cH:21][cH:22][cH:23]1)([F:24])[F:25].[N:1]1([C:6]2=[CH:7][CH2:8][CH2:9][CH2:10][CH2:11]2)[CH2:2][CH2:3][CH2:4][CH2:5]1.[OH2:33]>>[C:6]1(=[O:33])[CH:7]([CH2:18][C:17]([c:16]2[cH:15][c:14]([C:13]([F:12])([F:24])[F:25])[cH:23][cH:22][cH:21]2)=[O:20])[CH2:8][CH2:9][CH2:10][CH2:11]1

참가 물질

5

출처 및 근거

ORD 기록
ord-56479900a256491f97ee1456f9984e0f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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