HRID950935

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID15413

Methyl tert-butyl ether

C5H12O

结构：O=S(=O)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

HCID67814

Perfluorobutanesulfonyl fluoride

C4F10O2S

HCID81184

1,8-Diazabicyclo[5.4.0]undec-7-ene

C9H16N2

HCID604055

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCCc1cnc(-c2ccc(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc2)nc1

HCID54237657

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-05b76a5668b3444e8c0294d6a9f06e82
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:39]([O:40][CH3:41])([CH3:42])([CH3:43])[CH3:44].[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH3:8])[c:9]1[cH:10][n:11][c:12](-[c:15]2[cH:16][cH:17][c:18]([OH:21])[cH:19][cH:20]2)[n:13][cH:14]1.[F:22][C:23]([C:24]([C:25]([C:26]([F:27])([F:28])[F:29])([F:30])[F:31])([F:32])[F:33])([S:34](=[O:35])(=[O:36])[F:37])[F:38].[N:45]12[CH2:46][CH2:47][CH2:48][N:49]=[C:50]1[CH2:51][CH2:52][CH2:53][CH2:54][CH2:55]2.[OH2:56]>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH3:8])[c:9]1[cH:10][n:11][c:12](-[c:15]2[cH:16][cH:17][c:18]([O:21][S:34]([C:23]([F:22])([C:24]([C:25]([C:26]([F:27])([F:28])[F:29])([F:30])[F:31])([F:32])[F:33])[F:38])(=[O:35])=[O:36])[cH:19][cH:20]2)[n:13][cH:14]1