HRID820634

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

2 次

HCID81531

Diisopropylethylamine

C8H19N

HCID577403

N-Methyl-1-phenylethylamine

C9H13N

HCID644041

Methanaminium

CH6N+

HCID4641409

(Dimethylamino)-N,N-dimethyl(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy)methaniminium

C10H15N6O+

结构：Cc1cc(C(F)(F)F)nn1CC(=O)N1CCC(c2cccc(C(=O)O)c2)CC1

HCID66973337

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(C(F)(F)F)nn1CC(=O)N1CCC(c2cccc(C(=O)N(C)C(C)c3ccccc3)c2)CC1

HCID66973485

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-01c575d3e4774b44968ff906be19912d
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:1][c:2]1[cH:3][c:4]([C:25]([F:26])([F:27])[F:28])[n:5][n:6]1[CH2:7][C:8](=[O:9])[N:10]1[CH2:11][CH2:12][CH:13]([c:16]2[cH:17][c:18]([C:19](=[O:20])[OH:21])[cH:22][cH:23][cH:24]2)[CH2:14][CH2:15]1.[CH3:38][NH3+:39].[CH3:71][NH:72][CH:73]([CH3:74])[c:75]1[cH:76][cH:77][cH:78][cH:79][cH:80]1.[CH:29]([N:30]([CH:31]([CH3:32])[CH3:33])[CH2:34][CH3:35])([CH3:36])[CH3:37].[O:81]=[CH:82][N:83]([CH3:84])[CH3:85].[P-:40]([F:41])([F:42])([F:43])([F:44])([F:45])[F:46].[P-:64]([F:65])([F:66])([F:67])([F:68])([F:69])[F:70].[n:47]1([O:48][C:49]([N:50]([CH3:51])[CH3:52])=[N+:53]([CH3:54])[CH3:55])[c:56]2[n:57][cH:58][cH:59][cH:60][c:61]2[n:62][n:63]1>>[CH3:1][c:2]1[cH:3][c:4]([C:25]([F:26])([F:27])[F:28])[n:5][n:6]1[CH2:7][C:8](=[O:9])[N:10]1[CH2:11][CH2:12][CH:13]([c:16]2[cH:17][c:18]([C:19](=[O:20])[N:72]([CH3:71])[CH:73]([CH3:74])[c:75]3[cH:76][cH:77][cH:78][cH:79][cH:80]3)[cH:22][cH:23][cH:24]2)[CH2:14][CH2:15]1