Ethanol → 1-Benzyl-4,4-dimethylpyrrolidin-3-ol

반응식

[CH3:1][S:2]([O:3][CH2:6][CH:7]([C:8]([CH2:9][O:4][S:5]([CH3:10])(=[O:11])=[O:12])([CH3:15])[CH3:16])[OH:17])(=[O:13])=[O:14].[CH3:26][CH2:27][OH:28].[NH2:18][CH2:19][c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1>>[CH2:6]1[CH:7]([OH:17])[C:8]([CH3:15])([CH3:16])[CH2:9][N:18]1[CH2:19][c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1

참가 물질

반응물 3

HCID 702Ethanol

HCID 7504Benzylamine

HCID 724802133-Hydroxy-2,2-dimethylbutane-1,4-diyl dimethanesulfonate

생성물 1

HCID 578552851-Benzyl-4,4-dimethylpyrrolidin-3-ol

출처 및 근거

ORD 기록: ord-3ffbc8afaf674a85b69525c277270247
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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