HRID1212835

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID3283

Diethyl Ether

C4H10O

HCID8058

n-Hexane

C6H14

结构：CC1=Cc2sc(C)c(-c3ccc(C(C)(C)C)cc3)c2C1

HCID21880328

未命名化合物

结构：CC(C)C1=Cc2c(-c3ccc(C(C)(C)C)cc3)cccc2C1[Si](C)(C)Cl

HCID21880365

1-(Chlorodimethylsilyl)-4-[4-(1,1-dimethylethyl)phenyl]-2-(1-methylethyl)-1H-indene

C24H31ClSi

HCID178418260

未命名化合物

HCID178418339

未命名化合物

PRODUCTS

生成物

结构：CC1=Cc2c(sc(C)c2-c2ccc(C(C)(C)C)cc2)C1[Si](C)(C)C1C(C(C)C)=Cc2c(-c3ccc(C(C)(C)C)cc3)cccc21

HCID21880339

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3342a4aa0aca499586e72af731c4cd8f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8](-[c:11]2[c:12]3[c:13]([s:14][c:15]2[CH3:16])[CH:17]=[C:18]([CH3:20])[CH2:19]3)[cH:9][cH:10]1.[CH2:21]([Li:22])[CH2:23][CH2:24][CH3:25].[CH3:26][CH2:27][CH2:28][CH2:29][CH2:30][CH3:31].[CH3:65][CH2:66][O:67][CH2:68][CH3:69].[Cl-:63].[Cl:37][Si:38]([CH3:39])([CH3:40])[CH:41]1[C:42]([CH:60]([CH3:61])[CH3:62])=[CH:43][c:44]2[c:45](-[c:50]3[cH:51][cH:52][c:53]([C:56]([CH3:57])([CH3:58])[CH3:59])[cH:54][cH:55]3)[cH:46][cH:47][cH:48][c:49]21.[Cu:32]([C:33]#[N:34])[C:35]#[N:36].[NH4+:64]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8](-[c:11]2[c:12]3[c:13]([s:14][c:15]2[CH3:16])[CH:17]([Si:38]([CH3:39])([CH3:40])[CH:41]2[C:42]([CH:60]([CH3:61])[CH3:62])=[CH:43][c:44]4[c:45](-[c:50]5[cH:51][cH:52][c:53]([C:56]([CH3:57])([CH3:58])[CH3:59])[cH:54][cH:55]5)[cH:46][cH:47][cH:48][c:49]42)[C:18]([CH3:20])=[CH:19]3)[cH:9][cH:10]1