HRID142016

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

3 次

HCID8028

Tetrahydrofuran

C4H8O

HCID15914

Phenyltrimethylammonium

C9H14N+

3 次

HCID21458980

5-Acetyl-2,3-dimethoxybenzonitrile

C11H11NO3

PRODUCTS

生成物

HCID21458961

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6c70188fd1e6461ca22965da83b01a36
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-:1].[Br-:2].[Br-:3].[C:34](#[N:35])[c:36]1[c:37]([O:47][CH3:48])[c:38]([O:45][CH3:46])[cH:39][c:40]([C:42]([CH3:43])=[O:44])[cH:41]1.[O:49]1[CH2:50][CH2:51][CH2:52][CH2:53]1.[c:14]1([N+:15]([CH3:16])([CH3:17])[CH3:18])[cH:19][cH:20][cH:21][cH:22][cH:23]1.[c:24]1([N+:25]([CH3:26])([CH3:27])[CH3:28])[cH:29][cH:30][cH:31][cH:32][cH:33]1.[c:4]1([N+:5]([CH3:6])([CH3:7])[CH3:8])[cH:9][cH:10][cH:11][cH:12][cH:13]1>>[Br:1][CH2:43][C:42]([c:40]1[cH:39][c:38]([O:45][CH3:46])[c:37]([O:47][CH3:48])[c:36]([C:34]#[N:35])[cH:41]1)=[O:44]