HRID1151751

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID240

Benzaldehyde

C7H6O

HCID312

Chloride

Cl-

2 次

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID1140

Toluene

C7H8

HCID7237

o-Xylene

C8H10

HCID8404

Tetralin

C10H12

HCID23939

Platinum

HCID24813

Phosphoric trichloride

Cl3OP

HCID24819

Phosphorus pentachloride

Cl5P

HCID28123

Tetrahydroborate

H4B-

HCID32051

Zinc (II) cation

Zn+2

HCID76705

G 1616

C9H9N

HCID178418361

未命名化合物

HCID178465531

未命名化合物

PRODUCTS

生成物

HCID7046

1,2,3,4-Tetrahydroisoquinoline

C9H11N

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dd51d0a155ef4e0baea5d88618ce20a5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[BH4-:41].[CH2:31]1[CH2:32][c:33]2[c:34]([cH:35][cH:36][cH:37][cH:38]2)[CH2:39][CH2:40]1.[CH3:1][CH:2]([NH-:3])[c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1.[CH3:66][c:67]1[cH:68][cH:69][cH:70][cH:71][cH:72]1.[CH:10]1=[N:11][CH2:12][CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]21.[CH:45]([c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1)=[O:52].[Cl-:55].[Cl-:57].[Cl:25][P:26]([Cl:27])([Cl:28])([Cl:29])[Cl:30].[ClH:54].[H:43][H:44].[Na+:42].[P:20]([Cl:21])([Cl:22])([Cl:23])=[O:24].[Pt:53].[Zn+2:56].[c:58]1([CH3:59])[c:60]([CH3:61])[cH:62][cH:63][cH:64][cH:65]1>>[CH2:10]1[NH:11][CH2:12][CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]21