查数据/反应详情

HRID107920

反应详情

EQUATION

反应方程式

HRID 107920 的结构方程式

REACTANTS

反应物

4

结构：C

Methane

CH4

结构：CCO

Ethanol

C2H6O

结构：[Pd]

Palladium

Pd

结构：CCOC(=O)C=CC1(C)Cc2c(cc(C(C)(C)C)c(O[Si](C)(C)C)c2C(C)(C)C)O1

未命名化合物

PRODUCTS

生成物

1

结构：CCOC(=O)CCC1(C)Cc2c(cc(C(C)(C)C)c(O[Si](C)(C)C)c2C(C)(C)C)O1

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a53e38af40804c1ab632c05c94ad4299
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:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([O:26][Si:27]([CH3:28])([CH3:29])[CH3:30])[c:7]([C:22]([CH3:23])([CH3:24])[CH3:25])[cH:8][c:9]2[c:10]1[CH2:11][C:12]([CH3:14])([CH:15]=[CH:16][C:17](=[O:18])[O:19][CH2:20][CH3:21])[O:13]2.[C:34].[CH3:31][CH2:32][OH:33].[Pd:35]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([O:26][Si:27]([CH3:28])([CH3:29])[CH3:30])[c:7]([C:22]([CH3:23])([CH3:24])[CH3:25])[cH:8][c:9]2[c:10]1[CH2:11][C:12]([CH3:14])([CH2:15][CH2:16][C:17](=[O:18])[O:19][CH2:20][CH3:21])[O:13]2

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