HRID2314984

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6569

Methyl ethyl ketone

C4H8O

HCID19660

Carbonate

CO3-2

HCID28557

18-Crown-6

C12H24O6

HCID181248

3-(2,2-Dibromoethenyl)-2,2-dimethylcyclopropanecarboxylic acid

C8H10Br2O2

HCID13106144

未命名化合物

PRODUCTS

生成物

结构：CC1(C)C(C=C(Br)Br)C1C(=O)OCc1nsc(Oc2ccccc2)n1

HCID178424126

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-798fb4f33e584a4b961dd56769aad9b2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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