Acetate → HCID 66707693, compound

HRID 677952Notes

Reaction equation

HRID 677952 reaction equation
[CH3:22][C:23](=[O:24])[O-:25].[CH3:26][C:27](=[O:28])[OH:29].[N+:17](=[O:18])([O-:19])[CH3:20].[NH4+:21].[c:1]1([NH:7][CH2:8][c:9]2[cH:10][cH:11][c:12]([CH:13]=[O:14])[cH:15][cH:16]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([NH:7][CH2:8][c:9]2[cH:10][cH:11][c:12]([CH:13]=[CH:20][N+:17](=[O:18])[O-:19])[cH:15][cH:16]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 175AcetateHCID 176Acetic AcidHCID 223AmmoniumHCID 6375NitromethaneHCID 59255443HCID 59255443, compound

Product 1

HCID 66707693HCID 66707693, compound

Sources & evidence

ORD record
ord-86a5367a5a934f5cbb76ed51090219d4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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