HRID1240509

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID16028

Tetrabutylammonium

C16H36N+

HCID28179

Fluoride

F-

结构：C#CCn1c(-c2ccc(OC)cc2CO[Si](C(C)C)(C(C)C)C(C)C)c(C2CCCCC2)c2ccc(C(=O)OC)cc21

HCID86637862

未命名化合物

PRODUCTS

生成物

结构：C#CCn1c(-c2ccc(OC)cc2CO)c(C2CCCCC2)c2ccc(C(=O)OC)cc21

HCID86637863

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2e59a2444f7c43a7abfae1e69b264d72
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

[CH2:61]1[O:62][CH2:63][CH2:64][CH2:65]1.[CH3:2][CH2:3][CH2:4][CH2:5][N+:6]([CH2:7][CH2:8][CH2:9][CH3:10])([CH2:11][CH2:12][CH2:13][CH3:14])[CH2:15][CH2:16][CH2:17][CH3:18].[CH3:66][CH2:67][O:68][C:69]([CH3:70])=[O:71].[CH:19]1([c:25]2[c:26](-[c:41]3[c:42]([CH2:49][O:50][Si:51]([CH:52]([CH3:53])[CH3:54])([CH:55]([CH3:56])[CH3:57])[CH:58]([CH3:59])[CH3:60])[cH:43][c:44]([O:47][CH3:48])[cH:45][cH:46]3)[n:27]([CH2:38][C:39]#[CH:40])[c:28]3[cH:29][c:30]([C:34](=[O:35])[O:36][CH3:37])[cH:31][cH:32][c:33]23)[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24]1.[F-:1]>>[CH:19]1([c:25]2[c:26](-[c:41]3[c:42]([CH2:49][OH:50])[cH:43][c:44]([O:47][CH3:48])[cH:45][cH:46]3)[n:27]([CH2:38][C:39]#[CH:40])[c:28]3[cH:29][c:30]([C:34](=[O:35])[O:36][CH3:37])[cH:31][cH:32][c:33]23)[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24]1