HRID701334

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3283

Diethyl Ether

C4H10O

HCID7258

3,4-Dichlorophenol

C6H4Cl2O

HCID11776

Triphenylphosphine

C18H15P

HCID66701044

tert-Butyl 9-hydroxy-3-azaspiro[5.5]undecane-3-carboxylate

C15H27NO3

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC2(CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1

HCID67463492

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-96cb164704da4d518d7b84d3d46551e7
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

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