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Benzene → Methyl 7-(2-formyl-6-oxopiperidin-1-yl)hept-5-enoate

HRID 2131407
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인쇄 미리보기

반응식

HRID 2131407 반응식
[CH3:1][S:2]([CH3:3])=[O:4].[CH3:5][O:6][C:7]([CH2:8][CH2:9][CH2:10][CH:11]=[CH:12][CH2:13][N:14]1[CH:15]([CH2:21][OH:22])[CH2:16][CH2:17][CH2:18][C:19]1=[O:20])=[O:23].[F:24][C:25]([F:26])([F:27])[C:28]([O-:29])=[O:30].[cH:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[nH+:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[CH3:5][O:6][C:7]([CH2:8][CH2:9][CH2:10][CH:11]=[CH:12][CH2:13][N:14]1[CH:15]([CH:21]=[O:22])[CH2:16][CH2:17][CH2:18][C:19]1=[O:20])=[O:23]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 241BenzeneHCID 679Dimethyl SulfoxideHCID 84468TrifluoroacetateHCID 4989215PyridiniumHCID 69022898Methyl 7-[2-(hydroxymethyl)-6-oxopiperidin-1-yl]hept-5-enoate

생성물 1

HCID 90797846Methyl 7-(2-formyl-6-oxopiperidin-1-yl)hept-5-enoate

출처 및 근거

ORD 기록
ord-9c8efb4530a340c78f741b9fcda1527f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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