Ammonium → Methyl 2-acetyl-3-methyl-3-phenylbutanoate

HRID 303882Notes

Reaction equation

HRID 303882 reaction equation
[Br-:1].[C:9]([CH3:10])(=[O:11])[C:12]([C:13](=[O:14])[O:15][CH3:16])=[C:17]([CH3:18])[CH3:19].[CH3:22][CH2:23][O:24][CH2:25][CH3:26].[Cl-:20].[Cu:27][I:28].[NH4+:21].[c:2]1([Mg+:8])[cH:3][cH:4][cH:5][cH:6][cH:7]1>>[c:2]1([C:17]([CH:12]([C:9]([CH3:10])=[O:11])[C:13](=[O:14])[O:15][CH3:16])([CH3:18])[CH3:19])[cH:3][cH:4][cH:5][cH:6][cH:7]1

Participants

8

Reactant 7

HCID 223AmmoniumHCID 259Bromide ionHCID 312ChlorideHCID 3283Diethyl EtherHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 12576903Methyl 2-acetyl-3-methylbut-2-enoateHCID 178507002HCID 178507002, compound

Product 1

HCID 86659735Methyl 2-acetyl-3-methyl-3-phenylbutanoate

Sources & evidence

ORD record
ord-001f5457280240309f64d4c3855fbfb6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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