Diethyl Ether → Bromide ion

HRID 2135722Notes

Reaction equation

HRID 2135722 reaction equation
[Br:24][CH2:25][C:26](=[O:27])[NH:28][c:29]1[n:30][cH:31][cH:32][n:33][cH:34]1.[CH3:35][CH2:36][O:37][CH2:38][CH3:39].[CH3:40][CH2:41][CH2:42][CH:43]([CH3:44])[CH3:45].[CH3:46][C:47]#[N:48].[N:1]12[CH2:2][CH:3]([O:9][C:10](=[O:11])[C:12]3([c:19]4[s:20][cH:21][cH:22][cH:23]4)[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18]3)[CH:4]([CH2:5][CH2:6]1)[CH2:7][CH2:8]2>>[Br-:24].[N+:1]12([CH2:25][C:26](=[O:27])[NH:28][c:29]3[n:30][cH:31][cH:32][n:33][cH:34]3)[CH2:2][CH:3]([O:9][C:10](=[O:11])[C:12]3([c:19]4[s:20][cH:21][cH:22][cH:23]4)[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18]3)[CH:4]([CH2:5][CH2:6]1)[CH2:7][CH2:8]2

Participants

7

Reactant 5

HCID 3283Diethyl EtherHCID 6342AcetonitrileHCID 78922-MethylpentaneHCID 445426692-bromo-N-(pyrazin-2-yl)acetamideHCID 66886760HCID 66886760, compound

Product 2

HCID 259Bromide ionHCID 75039532[1-[2-Oxo-2-(pyrazin-2-ylamino)ethyl]-1-azoniabicyclo[2.2.2]octan-3-yl] 1-thiophen-2-ylcycloheptane-1-carboxylate

Sources & evidence

ORD record
ord-b15db5d439934d09a62a25683352d74c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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