HRID695328

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID7456

Methylparaben

C8H8O3

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

HCID16028

Tetrabutylammonium

C16H36N+

HCID30165

Iodide ion

I-

HCID4073409

1-Chloro-3,7,11-trimethyl-2,6,10-dodecatriene

C15H25Cl

PRODUCTS

生成物

结构：COC(=O)c1ccc(OCC=C(C)CCC=C(C)CCC=C(C)C)cc1

HCID53799950

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a933e74ee61c4ca28903e2b104520fe9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[CH2:19]([CH:20]=[C:21]([CH3:22])[CH2:23][CH2:24][CH:25]=[C:26]([CH3:27])[CH2:28][CH2:29][CH:30]=[C:31]([CH3:32])[CH3:33])[Cl:34].[CH2:38]([N+:39]([CH2:40][CH2:41][CH2:42][CH3:43])([CH2:44][CH2:45][CH2:46][CH3:47])[CH2:48][CH2:49][CH2:50][CH3:51])[CH2:52][CH2:53][CH3:54].[CH3:12][N:13]1[CH2:14][CH2:15][CH2:16][C:17]1=[O:18].[CH3:1][O:2][C:3]([c:4]1[cH:5][cH:6][c:7]([OH:10])[cH:8][cH:9]1)=[O:11].[CH3:35][OH:36].[I-:37]>>[CH3:1][O:2][C:3]([c:4]1[cH:5][cH:6][c:7]([O:10][CH2:19][CH:20]=[C:21]([CH3:22])[CH2:23][CH2:24][CH:25]=[C:26]([CH3:27])[CH2:28][CH2:29][CH:30]=[C:31]([CH3:32])[CH3:33])[cH:8][cH:9]1)=[O:11]