HRID292322

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

3 次

HCID813

Potassium cation

K+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID16028

Tetrabutylammonium

C16H36N+

HCID28179

Fluoride

F-

HCID105144

Palladium(2+)

Pd+2

HCID10964922

Hept-1-ynyl-trimethyl-silane

C10H20Si

HCID57548041

未命名化合物

PRODUCTS

生成物

HCID57548055

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-29e25542b4d445e1a8cc89f9149a8b86
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:2]1[c:3](-[c:7]2[cH:8][n:9][cH:10][cH:11][cH:12]2)[n:4][o:5][cH:6]1.[C:13](#[C:14][CH2:15][CH2:16][CH2:17][CH2:18][CH3:19])[Si:20]([CH3:21])([CH3:22])[CH3:23].[CH2:30]([N+:31]([CH2:32][CH2:33][CH2:34][CH3:35])([CH2:36][CH2:37][CH2:38][CH3:39])[CH2:40][CH2:41][CH2:42][CH3:43])[CH2:44][CH2:45][CH3:46].[CH3:47][CH2:48][O:49][C:50](=[O:51])[CH3:52].[F-:29].[K+:28].[O-:24][C:25]([CH3:26])=[O:27].[O-:54][C:55]([CH3:56])=[O:57].[O-:58][C:59]([CH3:60])=[O:61].[O:62]=[CH:63][N:64]([CH3:65])[CH3:66].[Pd+2:53]>>[c:2]1([C:13]#[C:14][CH2:15][CH2:16][CH2:17][CH2:18][CH3:19])[c:3](-[c:7]2[cH:8][n:9][cH:10][cH:11][cH:12]2)[n:4][o:5][cH:6]1