HRID193950

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6342

Acetonitrile

C2H3N

HCID105055

Ytterbium(3+)

Yb+3

HCID520769

2-(Trifluoromethyl)oxirane

C3H3F3O

HCID2758875

Trifluoromethanesulfonate

CF3O3S-

3 次

结构：O=[N+]([O-])c1cccc(NCc2cccc(OC(F)(F)C(F)F)c2)c1

HCID23506093

未命名化合物

PRODUCTS

生成物

结构：O=[N+]([O-])c1cccc(N(Cc2cccc(OC(F)(F)C(F)F)c2)CC(O)C(F)(F)F)c1

HCID23506053

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-08763e53de5c4954a5f92b6a700f54da
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

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