HRID172772

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID11776

Triphenylphosphine

C18H15P

HCID24530

Hydrazoic acid

HN3

HCID220568

Diethyl azodicarboxylate

C6H10N2O4

结构：CCOC(=O)c1cn(CC)c2c(F)c(C3CC3CO)c(F)cc2c1=O

HCID14987199

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1cn(CC)c2c(F)c(C3CC3CN=[N+]=[N-])c(F)cc2c1=O

HCID178469759

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c3e8253a098a4ac0bad9161b126636a8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH2:1]([CH3:2])[n:3]1[cH:4][c:5]([C:21](=[O:22])[O:23][CH2:24][CH3:25])[c:6](=[O:20])[c:7]2[cH:8][c:9]([F:19])[c:10]([CH:14]3[CH:15]([CH2:17][OH:18])[CH2:16]3)[c:11]([F:13])[c:12]12.[NH:45]=[N+:46]=[N-:47].[O:48]=[C:49]([O:50][CH2:51][CH3:52])[N:53]=[N:54][C:55]([O:56][CH2:57][CH3:58])=[O:59].[c:26]1([P:27]([c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[cH:40][cH:41][cH:42][cH:43][cH:44]1.[cH:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1>>[CH2:1]([CH3:2])[n:3]1[cH:4][c:5]([C:21](=[O:22])[O:23][CH2:24][CH3:25])[c:6](=[O:20])[c:7]2[cH:8][c:9]([F:19])[c:10]([CH:14]3[CH:15]([CH2:17][N:45]=[N+:46]=[N-:47])[CH2:16]3)[c:11]([F:13])[c:12]12