Acetic Acid → 2,3,5-Trimethyl-1-oxidopyridin-1-ium

HRID 169374

반응식

[C:12]([OH:13])(=[O:14])[CH3:15].[CH3:1][c:2]1[n:3][cH:4][c:5]([CH3:9])[cH:6][c:7]1[CH3:8].[OH2:16].[OH:10][OH:11]>>[CH3:1][c:2]1[n+:3]([O-:10])[cH:4][c:5]([CH3:9])[cH:6][c:7]1[CH3:8]

참가 물질

반응물 4

HCID 176Acetic Acid

HCID 784Hydrogen Peroxide

HCID 962Water

HCID 127592,3,5-Trimethylpyridine

생성물 1

HCID 104869072,3,5-Trimethyl-1-oxidopyridin-1-ium

출처 및 근거

ORD 기록: ord-1eadcccddec94a6dbbb3d3debe18eb9c
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

연결된 노트

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