Isopropanol → Triadimenol

HRID 1211773

반응식

HRID 1211773 반응식
[CH:21]([OH:22])([CH3:23])[CH3:24].[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:6][CH:7]([C:8]([C:9]([CH3:10])([CH3:11])[CH3:12])=[O:13])[n:14]2[n:15][cH:16][n:17][cH:18]2)[cH:19][cH:20]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:6][CH:7]([CH:8]([C:9]([CH3:10])([CH3:11])[CH3:12])[OH:13])[n:14]2[n:15][cH:16][n:17][cH:18]2)[cH:19][cH:20]1

참가 물질

3

반응물 2

HCID 3776IsopropanolHCID 39385Triadimefon

생성물 1

HCID 41368Triadimenol

출처 및 근거

ORD 기록
ord-c2b0d81300424817adba50fe7d503c00
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

연결된 노트

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