HRID171270

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID1140

Toluene

C7H8

HCID8202

9-Octadecenoic acid, methyl ester

C19H36O2

HCID98388

2-(2-Aminoethyl)-1-methylpyrrolidine

C7H16N2

PRODUCTS

生成物

HCID69528569

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e6da356570ed49a6bb73f8811c4f5056
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

[CH3:10][O:11][C:12]([CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH:20]=[CH:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH3:29])=[O:30].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[ClH:31].[NH2:1][CH2:2][CH2:3][CH:4]1[N:5]([CH3:9])[CH2:6][CH2:7][CH2:8]1.[Na+:33].[OH-:32]>>[NH:1]([CH2:2][CH2:3][CH:4]1[N:5]([CH3:9])[CH2:6][CH2:7][CH2:8]1)[C:12](=[O:11])[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH:20]=[CH:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH3:29]