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Bromide ion → 2-Bromo-1-[3-tert-butyl-5-(2-methoxy-1-methoxymethylethoxy)phenyl]ethanone

HRID 124111
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HRID 124111 반응식
[Br-:22].[Br-:23].[Br-:24].[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([C:19]([CH3:20])=[O:21])[cH:8][c:9]([O:11][CH:12]([CH2:13][O:14][CH3:15])[CH2:16][O:17][CH3:18])[cH:10]1.[CH2:57]1[O:58][CH2:59][CH2:60][CH2:61]1.[CH3:55][OH:56].[Cl:62][CH2:63][Cl:64].[c:25]1([N+:26]([CH3:27])([CH3:28])[CH3:29])[cH:30][cH:31][cH:32][cH:33][cH:34]1.[c:35]1([N+:36]([CH3:37])([CH3:38])[CH3:39])[cH:40][cH:41][cH:42][cH:43][cH:44]1.[c:45]1([N+:46]([CH3:47])([CH3:48])[CH3:49])[cH:50][cH:51][cH:52][cH:53][cH:54]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([C:19]([CH2:20][Br:22])=[O:21])[cH:8][c:9]([O:11][CH:12]([CH2:13][O:14][CH3:15])[CH2:16][O:17][CH3:18])[cH:10]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 259Bromide ion3회HCID 887MethanolHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 15914Phenyltrimethylammonium3회HCID 580458731-[3-tert-Butyl-5-(2-methoxy-1-methoxymethylethoxy)phenyl]ethanone

생성물 1

HCID 58045776
2-Bromo-1-[3-tert-butyl-5-(2-methoxy-1-methoxymethylethoxy)phenyl]ethanone

출처 및 근거

ORD 기록
ord-9562293e8da34ee89a1355658f3f2195
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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