HRID136755

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID259

Bromide

Br-

HCID312

Chloride

Cl-

HCID3283

Diethyl Ether

C4H10O

HCID6555

1-Bromo-2-methylpropane

C4H9Br

HCID5462224

Magnesium

HCID19928733

4,8-Dimethyl-1-nonen-4-ol

C11H22O

HCID21786235

未命名化合物

HCID178448189

未命名化合物

PRODUCTS

生成物

结构：CC(C)CCCC(C)(O)CCCC(C)(O)C(C)NCCc1ccccc1

HCID19928744

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-be09a1045a8841278d01c55868bce725
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].[CH2:25]([c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)[CH2:32][NH:33][CH:34]([C:35]([CH3:36])=[O:37])[CH3:38].[CH2:2]([Mg+:3])[CH:4]([CH3:5])[CH3:6].[CH2:8]([Br:9])[CH:10]([CH3:11])[CH3:12].[CH3:13][C:14]([CH2:15][CH:16]=[CH2:17])([CH2:18][CH2:19][CH2:20][CH:21]([CH3:22])[CH3:23])[OH:24].[CH3:41][CH2:42][O:43][CH2:44][CH3:45].[Cl-:39].[Mg:7].[NH4+:40]>>[CH3:13][C:14]([CH2:15][CH2:16][CH2:17][C:35]([CH:34]([NH:33][CH2:32][CH2:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)[CH3:38])([CH3:36])[OH:37])([CH2:18][CH2:19][CH2:20][CH:21]([CH3:22])[CH3:23])[OH:24]