HRID310243

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID887

Methanol

CH4O

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

结构：CC(c1ccc2c(c1)C(C)(C)CCC2(C)C)[P+](c1ccccc1)(c1ccccc1)c1ccccc1

HCID11238303

未命名化合物

HCID13214687

4-(Ethanesulfonyl)benzaldehyde

C9H10O3S

PRODUCTS

生成物

结构：CCS(=O)(=O)c1ccc(C=C(C)c2ccc3c(c2)C(C)(C)CCC3(C)C)cc1

HCID55753

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fc2d95f057b840998092fce7bca59e73
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[Br-:1].[CH2:37]([CH3:38])[S:39](=[O:40])(=[O:41])[c:42]1[cH:43][cH:44][c:45]([CH:46]=[O:47])[cH:48][cH:49]1.[CH2:53]1[O:54][CH2:55][CH2:56][CH2:57]1.[CH3:2][C:3]1([CH3:36])[c:4]2[cH:5][cH:6][c:7]([CH:15]([CH3:16])[P+:17]([c:18]3[cH:19][cH:20][cH:21][cH:22][cH:23]3)([c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[cH:8][c:9]2[C:10]([CH3:13])([CH3:14])[CH2:11][CH2:12]1.[CH3:51][OH:52].[OH2:50]>>[CH3:2][C:3]1([CH3:36])[c:4]2[cH:5][cH:6][c:7]([C:15]([CH3:16])=[CH:46][c:45]3[cH:44][cH:43][c:42]([S:39]([CH2:37][CH3:38])(=[O:40])=[O:41])[cH:49][cH:48]3)[cH:8][c:9]2[C:10]([CH3:13])([CH3:14])[CH2:11][CH2:12]1