HRID823561

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3283

Diethyl Ether

C4H10O

HCID6342

Acetonitrile

C2H3N

HCID7892

2-Methylpentane

C6H14

HCID3416403

2-bromo-N-(3-fluorophenyl)acetamide

C8H7BrFNO

HCID66886760

未命名化合物

PRODUCTS

生成物

HCID259

Bromide

Br-

结构：O=C(C[N+]12CCC(CC1)C(OC(=O)C1(c3cccs3)CCCCCC1)C2)Nc1cccc(F)c1

HCID87351019

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-83014018f04246ee83d33dc3231b6e93
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

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