HRID948976

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID4641409

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

C10H15N6O+

HCID17039435

3-Amino-3-(4-chlorophenyl)propan-1-ol

C9H12ClNO

HCID57750394

未命名化合物

PRODUCTS

产物

HCID57750387

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-4c6a33a0a26e4d749b0a72d851c0bf69
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应SMILES

[C:13]([CH3:14])([CH3:15])([CH3:16])[O:17][C:18](=[O:19])[NH:20][C:21]1([C:36](=[O:37])[OH:38])[CH2:22][CH2:23][N:24]([c:27]2[c:28]3[c:29]([n:30][cH:31][n:32]2)[nH:33][cH:34][cH:35]3)[CH2:25][CH2:26]1.[CH:39]([N:40]([CH2:41][CH3:42])[CH:43]([CH3:44])[CH3:45])([CH3:46])[CH3:47].[NH2:1][CH:2]([CH2:3][CH2:4][OH:5])[c:6]1[cH:7][cH:8][c:9]([Cl:12])[cH:10][cH:11]1.[P-:48]([F:49])([F:50])([F:51])([F:52])([F:53])[F:54].[n:55]1([O:56][C:57]([N:58]([CH3:59])[CH3:60])=[N+:61]([CH3:62])[CH3:63])[c:64]2[n:65][cH:66][cH:67][cH:68][c:69]2[n:70][n:71]1>>[NH:1]([CH:2]([CH2:3][CH2:4][OH:5])[c:6]1[cH:7][cH:8][c:9]([Cl:12])[cH:10][cH:11]1)[C:36]([C:21]1([NH:20][C:18]([O:17][C:13]([CH3:14])([CH3:15])[CH3:16])=[O:19])[CH2:22][CH2:23][N:24]([c:27]2[c:28]3[c:29]([n:30][cH:31][n:32]2)[nH:33][cH:34][cH:35]3)[CH2:25][CH2:26]1)=[O:37]