HRID316480

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID813

Potassium cation

K+

HCID8028

Tetrahydrofuran

C4H8O

结构：c1ccc([P+](CCC2OCCCO2)(c2ccccc2)c2ccccc2)cc1

HCID2724169

未命名化合物

HCID4574913

未命名化合物

HCID11769829

4-(4-Formylcyclohexyl)benzonitrile

C14H15NO

PRODUCTS

生成物

HCID53742275

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ca461a1fe669485e898d0226705799da
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[Br-:1].[C:35](#[N:36])[c:37]1[cH:38][cH:39][c:40]([CH:43]2[CH2:44][CH2:45][CH:46]([CH:49]=[O:50])[CH2:47][CH2:48]2)[cH:41][cH:42]1.[CH2:51]1[O:52][CH2:53][CH2:54][CH2:55]1.[CH3:29][C:30]([CH3:31])([O-:32])[CH3:33].[K+:34].[O:2]1[CH:3]([CH2:8][CH2:9][P+:10]([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)([c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[O:4][CH2:5][CH2:6][CH2:7]1>>[O:2]1[CH:3]([CH2:8][CH:9]=[CH:49][CH:46]2[CH2:45][CH2:44][CH:43]([c:40]3[cH:39][cH:38][c:37]([C:35]#[N:36])[cH:42][cH:41]3)[CH2:48][CH2:47]2)[O:4][CH2:5][CH2:6][CH2:7]1