HRID702670

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID16028

Tetrabutylammonium

C16H36N+

HCID28179

Fluoride

F-

结构：CC(C)(CO[Si](C)(C)C(C)(C)C)c1nnc2ccc(-c3c(-c4ccc(F)cc4F)nc4n3CCC4)nn12

HCID57929978

未命名化合物

PRODUCTS

生成物

结构：CC(C)(CO)c1nnc2ccc(-c3c(-c4ccc(F)cc4F)nc4n3CCC4)nn12

HCID49830960

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c2da2d57b1524b0794090dcd6f60eee8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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