HRID321058

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID887

Methanol

CH4O

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

结构：C[Si](C)(C)C#Cc1cccc(-c2c(Cc3ccccc3)cnc3c(C(F)(F)F)cccc23)c1

HCID66913838

未命名化合物

PRODUCTS

生成物

结构：C#Cc1cccc(-c2c(Cc3ccccc3)cnc3c(C(F)(F)F)cccc23)c1

HCID86055589

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-59577bb621f643008c091af5b3c7a0d2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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