HRID289606

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID8037

N,N,N',N'-Tetramethylethylenediamine

C6H16N2

HCID28486

Lithium ion

Li+

HCID588396

2-Methylisophthalonitrile

C9H6N2

HCID5062348

未命名化合物

HCID10947018

Benzene, (8-iodooctyl)-

C14H21I

PRODUCTS

生成物

HCID19930263

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-737a651384fe4d30ad80a1bbe10b4029
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

[C:9](#[N:10])[c:11]1[c:12]([CH3:19])[c:13]([C:17]#[N:18])[cH:14][cH:15][cH:16]1.[CH3:20][N:21]([CH3:22])[CH2:23][CH2:24][N:25]([CH3:26])[CH3:27].[CH:1]([N-:2][CH:3]([CH3:4])[CH3:5])([CH3:6])[CH3:7].[Li+:8].[O:43]1[CH2:44][CH2:45][CH2:46][CH2:47]1.[OH2:48].[c:28]1([CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][I:42])[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[C:9](#[N:10])[c:11]1[c:12]([CH2:19][CH2:41][CH2:40][CH2:39][CH2:38][CH2:37][CH2:36][CH2:35][CH2:34][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:13]([C:17]#[N:18])[cH:14][cH:15][cH:16]1