Acetate → HCID 66785817, compound

HRID 143342Notes

Reaction equation

HRID 143342 reaction equation
[CH3:22][C:23](=[O:24])[O-:25].[N+:27](=[O:28])([O-:29])[CH3:30].[NH4+:21].[OH2:26].[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[cH:11][cH:12][c:13]3[c:14]([CH:19]=[O:20])[cH:15][cH:16][cH:17][c:18]23)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[cH:11][cH:12][c:13]3[c:14]([CH:19]=[CH:30][N+:27](=[O:28])[O-:29])[cH:15][cH:16][cH:17][c:18]23)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 175AcetateHCID 223AmmoniumHCID 962WaterHCID 6375NitromethaneHCID 10107997HCID 10107997, compound

Product 1

HCID 66785817HCID 66785817, compound

Sources & evidence

ORD record
ord-446cc2c3d5e4476eab2ee5b0b69c7c44
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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