HRID2332802

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID11776

Triphenylphosphine

C18H15P

HCID75555

未命名化合物

HCID10942771

2,3-Dihydro-2,2-dimethyl-1H-inden-1-ol

C11H14O

HCID178418785

未命名化合物

PRODUCTS

生成物

HCID21873096

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1117d8fab9b14967ae1b609918742d8f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH2:55]1[O:56][CH2:57][CH2:58][CH2:59]1.[CH3:1][C:2]1([CH3:12])[CH:3]([OH:11])[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[CH2:10]1.[CH3:65][CH2:66][O:67][C:68](=[O:69])[CH3:70].[Na+:64].[O-:60][C:61]([OH:62])=[O:63].[O:41]=[C:42]([O:43][CH:44]([CH3:45])[CH3:46])[N:47]=[N:48][C:49]([O:50][CH:51]([CH3:52])[CH3:53])=[O:54].[c:22]1([P:23]([c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[cH:36][cH:37][cH:38][cH:39][cH:40]1.[nH:13]1[cH:14][n:15][c:16]([C:18](=[O:19])[O:20][CH3:21])[cH:17]1>>[CH3:1][C:2]1([CH3:12])[CH:3]([n:15]2[cH:14][n:13][cH:17][c:16]2[C:18](=[O:19])[O:20][CH3:21])[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[CH2:10]1