查数据/反应详情

HRID121648

反应详情

EQUATION

反应方程式

HRID 121648 的结构方程式

REACTANTS

反应物

2

结构：CC(C)=CC=C(C)C

2,5-Dimethyl-2,4-hexadiene

C8H14

结构：CC(C)(C)OC(=O)C=[N+]=[N-]

t-butyl diazoacetate

C6H10N2O2

PRODUCTS

生成物

1

结构：CC(C)=CC1C(C(=O)OC(C)(C)C)C1(C)C

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c533a89482f441c3a3880ff0eceb2acd
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

[CH3:1][C:2]([CH3:3])=[CH:4][CH:5]=[C:6]([CH3:7])[CH3:8].[N+:9](=[N-:10])=[CH:11][C:12](=[O:13])[O:14][C:15]([CH3:16])([CH3:17])[CH3:18]>>[CH3:1][C:2]([CH3:3])=[CH:4][CH:5]1[C:6]([CH3:7])([CH3:8])[CH:11]1[C:12](=[O:13])[O:14][C:15]([CH3:16])([CH3:17])[CH3:18]

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