Acetate → HCID 66707852, compound

HRID 313034Notes

Reaction equation

HRID 313034 reaction equation
[CH3:21][C:22](=[O:23])[O-:24].[CH3:25][C:26](=[O:27])[OH:28].[N+:16](=[O:17])([O-:18])[CH3:19].[NH4+:20].[o:1]1[c:2]([CH2:6][CH2:7][c:8]2[cH:9][cH:10][c:11]([CH:12]=[O:13])[cH:14][cH:15]2)[cH:3][cH:4][cH:5]1>>[o:1]1[c:2]([CH2:6][CH2:7][c:8]2[cH:9][cH:10][c:11]([CH:12]=[CH:19][N+:16](=[O:17])[O-:18])[cH:14][cH:15]2)[cH:3][cH:4][cH:5]1

Participants

6

Reactant 5

HCID 175AcetateHCID 176Acetic AcidHCID 223AmmoniumHCID 6375NitromethaneHCID 59255346HCID 59255346, compound

Product 1

HCID 66707852HCID 66707852, compound

Sources & evidence

ORD record
ord-8a47c1bfd25a45e887741527f19caa76
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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