HRID1544147

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID813

Potassium cation

K+

HCID3283

Diethyl Ether

C4H10O

HCID6342

Acetonitrile

C2H3N

HCID28179

Fluoride

F-

HCID28557

18-Crown-6

C12H24O6

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

HCID164912

Tetraphenylphosphonium

C24H20P+

HCID22248202

5-Chloro-3-(1,1-dimethylethoxy)-2-pyrazinecarboxaldehyde

C9H11ClN2O2

PRODUCTS

生成物

HCID22248252

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-81c03334f5e54e3cac8ee44f940ed75c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[Br-:43].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][c:6]1[c:7]([CH:13]=[O:14])[n:8][cH:9][c:10]([Cl:12])[n:11]1.[CH3:35][CH2:36][O:37][CH2:38][CH3:39].[CH3:40][C:41]#[N:42].[F-:15].[K+:16].[O:17]1[CH2:18][CH2:19][O:20][CH2:21][CH2:22][O:23][CH2:24][CH2:25][O:26][CH2:27][CH2:28][O:29][CH2:30][CH2:31][O:32][CH2:33][CH2:34]1.[c:44]1([P+:45]([c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[cH:64][cH:65][cH:66][cH:67][cH:68]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][c:6]1[c:7]([CH:13]=[O:14])[n:8][cH:9][c:10]([F:15])[n:11]1