HRID160978

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID15413

Methyl tert-butyl ether

C5H12O

HCID73728

Ethyl(triphenyl)phosphonium

C20H20P+

结构：O=CC1CCC(c2ccc(-c3ccc(F)c(F)c3)cc2)CC1

HCID19094938

未命名化合物

PRODUCTS

生成物

结构：CC=CC1CCC(c2ccc(-c3ccc(F)c(F)c3)cc2)CC1

HCID54186848

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a64eedcd112b405b817f8695ac86ae72
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[Br-:29].[CH2:30]([P+:31]([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)([c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1)[c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1)[CH3:50].[CH3:23][O:24][C:25]([CH3:26])([CH3:27])[CH3:28].[F:1][c:2]1[cH:3][c:4](-[c:9]2[cH:10][cH:11][c:12]([CH:15]3[CH2:16][CH2:17][CH:18]([CH:21]=[O:22])[CH2:19][CH2:20]3)[cH:13][cH:14]2)[cH:5][cH:6][c:7]1[F:8]>>[F:1][c:2]1[cH:3][c:4](-[c:9]2[cH:10][cH:11][c:12]([CH:15]3[CH2:16][CH2:17][CH:18]([CH:21]=[CH:25][CH3:26])[CH2:19][CH2:20]3)[cH:13][cH:14]2)[cH:5][cH:6][c:7]1[F:8]