HRID136856

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID75051

(Triphenylphosphoranylidene)acetaldehyde

C20H17OP

结构：Cc1ccc(C(=C(C=O)c2nnnn2C)c2ccc(C)cc2F)c(F)c1

HCID14723994

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(C(=C(C=CC=O)c2nnnn2C)c2ccc(C)cc2F)c(F)c1

HCID54207376

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3409126c496c46719bc0b1685053d5c0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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