Acetaldehyde → 2-Acetyl-3,5-dimethylpyrazine

HRID 137325Notes

Reaction equation

HRID 137325 reaction equation
[C:17]([O:18][OH:19])([CH3:20])([CH3:21])[CH3:22].[CH3:1][c:2]1[n:3][c:4]([CH3:8])[cH:5][n:6][cH:7]1.[CH:14]([CH3:15])=[O:16].[Na+:31].[Na+:32].[O-:33][S:34](=[O:35])(=[O:36])[O-:37].[S:23]([S:24]([O-:25])(=[O:26])=[O:27])([O-:28])(=[O:29])=[O:30].[S:9](=[O:10])(=[O:11])([OH:12])[OH:13]>>[CH3:1][c:2]1[n:3][c:4]([CH3:8])[c:5]([C:14]([CH3:15])=[O:16])[n:6][cH:7]1

Participants

8

Reactant 7

HCID 177AcetaldehydeHCID 923Sodium ion2×HCID 1117Sulfate IonHCID 1118Sulfuric AcidHCID 6410tert-Butyl hydroperoxideHCID 79382,6-DimethylpyrazineHCID 3082075Dithionate

Product 1

HCID 1047212-Acetyl-3,5-dimethylpyrazine

Sources & evidence

ORD record
ord-b76df021779944d5beeacaed1b1bf421
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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