Chloride → 4'-Isobutylhexanophenone
반응식
[Al+3:2].[C:5]([CH2:6][CH2:7][CH2:8][CH2:9][CH3:10])(=[O:11])[Cl:12].[CH3:13][CH:14]([CH3:15])[CH2:16][c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1.[Cl-:1].[Cl-:3].[Cl-:4].[Cl:24][CH2:25][Cl:26].[OH2:23]>>[C:5]([CH2:6][CH2:7][CH2:8][CH2:9][CH3:10])(=[O:11])[c:20]1[cH:19][cH:18][c:17]([CH2:16][CH:14]([CH3:13])[CH3:15])[cH:22][cH:21]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-98b990cac4d24b5fa85e2fe23426da13
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
반응 노트
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