HRID122622

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID813

Potassium cation

K+

2 次

HCID3776

Isopropanol

C3H8O

HCID19660

Carbonate

CO3-2

HCID75506

Benzylvanillin

C15H14O3

结构：CCOC(=O)C(OCC)[P+](c1ccccc1)(c1ccccc1)c1ccccc1

HCID3547991

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(=Cc1ccc(OCc2ccccc2)c(OC)c1)OCC

HCID53757958

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2a24ed30e6804009bd3fead7500012e6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:48](=[O:49])([O-:50])[O-:51].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([O:17][CH3:18])[cH:11][c:12]([CH:13]=[O:14])[cH:15][cH:16]1.[CH2:20]([CH3:21])[O:22][CH:23]([C:24](=[O:25])[O:26][CH2:27][CH3:28])[P+:29]([c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)([c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)[c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[CH:54]([OH:55])([CH3:56])[CH3:57].[Cl-:19].[K+:52].[K+:53]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([O:17][CH3:18])[cH:11][c:12]([CH:13]=[C:23]([O:22][CH2:20][CH3:21])[C:24](=[O:25])[O:26][CH2:27][CH3:28])[cH:15][cH:16]1