Hydrogen Bromide → HCID 4456250, compound

Reaction equation

[BrH:23].[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([NH:14][C:15](=[O:16])[CH3:17])[cH:7][cH:8][c:9]([N+:11](=[O:12])[O-:13])[cH:10]1.[CH3:24][CH2:25][O:26][C:27]([CH3:28])=[O:29].[Na+:22].[O-:18][C:19]([OH:20])=[O:21]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([NH2:14])[cH:7][cH:8][c:9]([N+:11](=[O:12])[O-:13])[cH:10]1

Participants

Reactant 5

HCID 260Hydrogen Bromide

HCID 769Bicarbonate Ion

HCID 923Sodium Ion

HCID 8857Ethyl Acetate

HCID 24824867HCID 24824867, compound

Product 1

HCID 4456250HCID 4456250, compound

Sources & evidence

ORD record: ord-e058e59af3be4ed0bceef8242bd03382
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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