HRID186718

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6342

Acetonitrile

C2H3N

HCID8471

Triethylamine

C6H15N

HCID199401

Phosphinic azide, diphenyl-

C12H10N3OP

结构：CCOC(=O)CC(=O)c1cc(F)c(O)nc1Nc1ccc(F)cc1F

HCID178472175

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)CC(=O)c1cc(F)c(N=[N+]=[N-])nc1Nc1ccc(F)cc1F

HCID13849326

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-80929dec7b104f6c8f82fd4f072b1b96
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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