HRID933426

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

5 次

HCID3024

Dibromomethane

CH2Br2

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID8037

N,N,N',N'-Tetramethylethylenediamine

C6H16N2

HCID23994

Zinc

HCID114942

Titanium(4+)

Ti+4

结构：CC(C)(C)OC(=O)N1CCC(c2ccc(F)cc2)C(OC(=O)c2ccc3ccccc3c2)C1

HCID54107379

未命名化合物

PRODUCTS

生成物

结构：C=C(OC1CN(C(=O)OC(C)(C)C)CCC1c1ccc(F)cc1)c1ccc2ccccc2c1

HCID53663664

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-aa3be28f7f134de9bab6df19854a3d09
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

[Br:9][CH2:10][Br:11].[CH2:47]([Cl:48])[Cl:49].[CH3:1][N:2]([CH3:3])[CH2:4][CH2:5][N:6]([CH3:7])[CH3:8].[Cl-:45].[Cl-:55].[Cl-:56].[Cl-:57].[Cl-:58].[F:12][c:13]1[cH:14][cH:15][c:16]([CH:19]2[CH:20]([O:32][C:33](=[O:34])[c:35]3[cH:36][c:37]4[cH:38][cH:39][cH:40][cH:41][c:42]4[cH:43][cH:44]3)[CH2:21][N:22]([C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[CH2:23][CH2:24]2)[cH:17][cH:18]1.[NH4+:46].[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1.[Ti+4:59].[Zn:60]>>[CH2:1]=[C:33]([O:32][CH:20]1[CH:19]([c:16]2[cH:15][cH:14][c:13]([F:12])[cH:18][cH:17]2)[CH2:24][CH2:23][N:22]([C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[CH2:21]1)[c:35]1[cH:36][c:37]2[cH:38][cH:39][cH:40][cH:41][c:42]2[cH:43][cH:44]1