HRID282002

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID3283

Diethyl Ether

C4H10O

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID19660

Carbonate

CO3-2

HCID351621

未命名化合物

HCID585891

4-(Trifluoromethyl)-1H-imidazole

C4H3F3N2

HCID10942771

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

C11H14O

PRODUCTS

生成物

HCID59199360

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8eb905fe6f1449a6a53af324b1c2bae9
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

[C:58](=[O:59])([O-:60])[O-:61].[CH2:64]1[O:65][CH2:66][CH2:67][CH2:68]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.[CH3:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1.[CH3:69][CH2:70][O:71][CH2:72][CH3:73].[F:13][C:14]([c:15]1[cH:16][n:17][cH:18][nH:19]1)([F:20])[F:21].[N:41]([C:42]([O:43][CH3:44])=[O:45])=[N:46][C:47]([O:48][CH3:49])=[O:50].[Na+:62].[Na+:63].[OH2:74].[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>>[CH3:1][C:2]1([CH3:12])[CH:3]([n:19]2[c:15]([C:14]([F:13])([F:20])[F:21])[cH:16][n:17][cH:18]2)[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[CH2:10]1