HRID1549455

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID222

Ammonia gas

H3N

HCID813

Potassium cation

K+

HCID887

Methanol

CH4O

HCID6386

tert-Butyl alcohol

C4H10O

HCID7504

Benzylamine

C7H9N

HCID8028

Tetrahydrofuran

C4H8O

HCID4574913

未命名化合物

PRODUCTS

生成物

HCID57355660

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7d0695ab8569409aa51be1b2cf7142eb
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[CH2:116]1[O:117][CH2:118][CH2:119][CH2:120]1.[CH3:109][C:110]([OH:111])([CH3:112])[CH3:113].[CH3:114][OH:115].[CH3:71][C:72]([CH3:73])([O-:74])[CH3:75].[CH3:77][O:78][C:79](=[O:80])[CH:81]([c:82]1[c:83]2[c:84]3[c:85]([cH:86][cH:87][cH:88]2)[CH2:89][CH2:90][CH2:91][n:92]3[cH:93]1)[CH:94]([c:95]1[c:96]2[c:97]([cH:98][cH:99][cH:100][cH:101]2)[nH:102][cH:103]1)[C:104]([O:105][CH3:106])=[O:107].[K+:76].[NH2:1][CH2:2][c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1.[NH3:108].[c:43]1([CH:44]2[CH:45]([c:46]3[c:47]4[c:48]([cH:49][cH:50][cH:51][cH:52]4)[nH:53][cH:54]3)[C:55](=[O:56])[NH:57][C:58]2=[O:59])[c:60]2[c:61]3[c:62]([cH:63][cH:64][cH:65]2)[CH2:66][CH2:67][CH2:68][n:69]3[cH:70]1.[c:9]1([CH:21]2[C:22](=[O:42])[N:23]([c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[C:24](=[O:35])[CH:25]2[c:26]2[cH:27][nH:28][c:29]3[cH:30][cH:31][cH:32][cH:33][c:34]23)[cH:10][n:11]2[c:20]3[c:15]([cH:16][cH:17][cH:18][c:19]13)[CH2:14][CH2:13][CH2:12]2>>[c:9]1([CH:21]2[C:22](=[O:42])[NH:23][C:24](=[O:35])[CH:25]2[c:26]2[cH:27][nH:28][c:29]3[cH:30][cH:31][cH:32][cH:33][c:34]23)[cH:10][n:11]2[c:20]3[c:15]([cH:16][cH:17][cH:18][c:19]13)[CH2:14][CH2:13][CH2:12]2