Nitric Acid → 3'-Nitrobutyrophenone

반응식

[C:5]([CH2:6][CH2:7][CH3:8])(=[O:9])[c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1.[N+:21]([O-:22])([OH:23])=[O:24].[OH:1][N+:2]([O-:3])=[O:4].[S:16](=[O:17])(=[O:18])([OH:19])[OH:20].[S:25](=[O:26])(=[O:27])([OH:28])[OH:29]>>[O-:1][N+:2](=[O:4])[c:12]1[cH:11][c:10]([C:5]([CH2:6][CH2:7][CH3:8])=[O:9])[cH:15][cH:14][cH:13]1

참가 물질

반응물 3

HCID 944Nitric Acid2회

HCID 1118Sulfuric Acid2회

HCID 10315Butyrophenone

생성물 1

HCID 1427473'-Nitrobutyrophenone

출처 및 근거

ORD 기록: ord-ce58cfd10d3947a884c9412e29c90d16
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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