HRID1216145

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID813

Potassium cation

K+

HCID6344

Dichloromethane

CH2Cl2

HCID26255

Tetrafluoroborate

BF4-

HCID61778

Bisulfate anion

HO4S-

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

未命名化合物

HCID1514290

Azetidin-3-ol

C3H7NO

HCID67167194

未命名化合物

PRODUCTS

生成物

HCID67773077

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2eb3b53140c6487f8ea14a63528d4792
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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