HRID98844

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6342

Acetonitrile

C2H3N

HCID8857

Ethyl Acetate

C4H8O2

HCID8900

Heptane

C7H16

HCID19660

Carbonate Ion

CO3-2

HCID22708453

2-(4-Methylsulfonyloxyphenyl)ethylmethanesulfonate

C10H13O6S2-

HCID53898840

未命名化合物

PRODUCTS

产物

HCID57186134

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-76477c371ffd429a94b9b02e314a1e9a
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:38](=[O:39])([O-:40])[O-:41].[C:51]([O:52][CH2:53][CH3:54])(=[O:55])[CH3:56].[CH3:19][O:20][C:21]([CH:22]([CH2:23][c:24]1[c:25]([N+:31](=[O:32])[O-:33])[cH:26][c:27]([OH:30])[cH:28][cH:29]1)[O:34][CH2:35][CH3:36])=[O:37].[CH3:1][S:2](=[O:3])(=[O:4])[O:5][c:6]1[cH:7][cH:8][c:9]([CH2:12][CH2:13][CH2:14][S:15]([O-:16])(=[O:17])=[O:18])[cH:10][cH:11]1.[CH3:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH3:50].[CH3:57][C:58]#[N:59].[K+:42].[K+:43]>>[CH3:1][S:2](=[O:3])(=[O:4])[O:5][c:6]1[cH:7][cH:8][c:9]([CH2:12][CH2:13][O:30][c:27]2[cH:26][c:25]([N+:31](=[O:32])[O-:33])[c:24]([CH2:23][CH:22]([C:21]([O:20][CH3:19])=[O:37])[O:34][CH2:35][CH3:36])[cH:29][cH:28]2)[cH:10][cH:11]1