HRID294040

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7892

2-Methylpentane

C6H14

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID11776

Triphenylphosphine

C18H15P

HCID16376

Pyrazole, 4-nitro-

C3H3N3O2

HCID75555

未命名化合物

HCID643502

n-boc-4-hydroxypiperidine

C10H19NO3

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(n2cc([N+](=O)[O-])cn2)CC1

HCID56777238

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f0fd1c2ab4374705911d0eee859b7477
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH2:56]1[O:57][CH2:58][CH2:59][CH2:60]1.[CH3:61][CH2:62][CH2:63][CH:64]([CH3:65])[CH3:66].[CH3:67][CH2:68][O:69][C:70]([CH3:71])=[O:72].[N+:15](=[O:16])([O-:17])[c:18]1[cH:19][n:20][nH:21][cH:22]1.[O:1]=[C:2]([O:3][CH:4]([CH3:5])[CH3:6])[N:7]=[N:8][C:9]([O:10][CH:11]([CH3:12])[CH3:13])=[O:14].[OH:23][CH:24]1[CH2:25][CH2:26][N:27]([C:30](=[O:31])[O:32][C:33]([CH3:34])([CH3:35])[CH3:36])[CH2:28][CH2:29]1.[c:37]1([P:38]([c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[cH:51][cH:52][cH:53][cH:54][cH:55]1>>[N+:15](=[O:16])([O-:17])[c:18]1[cH:19][n:20][n:21]([CH:24]2[CH2:25][CH2:26][N:27]([C:30](=[O:31])[O:32][C:33]([CH3:34])([CH3:35])[CH3:36])[CH2:28][CH2:29]2)[cH:22]1