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Ethanol → 2-(3,4-Dimethoxyphenyl)-3-oxopropanenitrile

HRID 99577
Notes
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Reaction equation

HRID 99577 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:11][C:12]#[N:13])[cH:6][cH:7][c:8]1[O:9][CH3:10].[CH3:20][CH2:21][O-:22].[CH3:23][CH2:24][OH:25].[CH:14](=[O:15])[O:16][CH2:17][CH3:18].[Na+:19]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH:11]([C:12]#[N:13])[CH:14]=[O:15])[cH:6][cH:7][c:8]1[O:9][CH3:10]
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium IonHCID 8025Ethyl formateHCID 667273,4-DimethoxybenzeneacetonitrileHCID 1194401-Hydroxyethyl radical

Product 1

HCID 164773122-(3,4-Dimethoxyphenyl)-3-oxopropanenitrile

Sources & evidence

ORD record
ord-f25f2e6760a84c7083eff94964fc0b79
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes