Dichloromethane → 9,10-Epoxy-6,9,10-trimethyl-undec-5-en-2-one

반응식

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

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 70297m-Chloroperbenzoic acid

HCID 545072266,9,10-Trimethyl-undeca-5,9-dien-2-one

생성물 1

HCID 541284819,10-Epoxy-6,9,10-trimethyl-undec-5-en-2-one

출처 및 근거

ORD 기록: ord-3ce0e7ce3d014b5d84190a991302448a
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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