HRID105867

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID7912

Diisopropylamine

C6H15N

HCID8028

Tetrahydrofuran

C4H8O

HCID28486

Lithium ion

Li+

HCID78109

Benzaldehyde, 4-(phenylmethoxy)-

C14H12O2

HCID247453

Ethyl 2-ethoxypropanoate

C7H14O3

HCID5062348

未命名化合物

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

产物

反应SMILES：CCOC(=O)C(C)(OCC)C(O)c1ccc(OCc2ccccc2)cc1

HCID54294698

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-62732dae379d46c5b336ecc0893ea858
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

[CH2:13]([CH3:14])[O:15][C:16]([CH:17]([CH3:18])[O:19][CH2:20][CH3:21])=[O:22].[CH2:31]([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)[O:38][c:39]1[cH:40][cH:41][c:42]([CH:43]=[O:44])[cH:45][cH:46]1.[CH2:8]([Li:9])[CH2:10][CH2:11][CH3:12].[CH3:24][CH:25]([N-:26][CH:27]([CH3:28])[CH3:29])[CH3:30].[CH:1]([NH:2][CH:3]([CH3:4])[CH3:5])([CH3:6])[CH3:7].[Cl-:47].[Li+:23].[NH4+:48].[O:49]1[CH2:50][CH2:51][CH2:52][CH2:53]1>>[CH2:13]([CH3:14])[O:15][C:16]([C:17]([CH3:18])([O:19][CH2:20][CH3:21])[CH:43]([c:42]1[cH:41][cH:40][c:39]([O:38][CH2:31][c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[cH:46][cH:45]1)[OH:44])=[O:22]