HRID2124638

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

HCID1118

Sulfuric acid

H2O4S

HCID7410

Acetophenone

C8H8O

HCID7749

Ethyl propionate

C5H10O2

HCID8028

Tetrahydrofuran

C4H8O

HCID26541

Dibenzo-18-crown-6

C20H24O6

HCID166653

Hydride

H-

PRODUCTS

生成物

HCID21408

Propionyl acetophenone

C11H12O2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6e40a0230c584bffb84be1c43794a633
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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