Acetate → HCID 53860532, compound

HRID 1563009Notes

Reaction equation

HRID 1563009 reaction equation
[CH3:21][C:22](=[O:23])[O-:24].[CH3:25][C:26](=[O:27])[OH:28].[CH3:5][N:6]([c:7]1[cH:8][c:9]([CH:10]=[O:11])[cH:12][c:13]([C:15]([F:16])([F:17])[F:18])[cH:14]1)[CH3:19].[N+:1](=[O:2])([O-:3])[CH3:4].[NH4+:20]>>[N+:1](=[O:2])([O-:3])[CH:4]=[CH:10][c:9]1[cH:8][c:7]([N:6]([CH3:5])[CH3:19])[cH:14][c:13]([C:15]([F:16])([F:17])[F:18])[cH:12]1

Participants

6

Reactant 5

HCID 175AcetateHCID 176Acetic AcidHCID 223AmmoniumHCID 6375NitromethaneHCID 18543782HCID 18543782, compound

Product 1

HCID 53860532HCID 53860532, compound

Sources & evidence

ORD record
ord-256fef709dd2453886c37920208fc2d7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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