CID 871334

2-amino-n-(4-bromophenyl)acetamide hydrochloride

Structural Information

Molecular Formula

C₈H₉BrN₂O

SMILES

C1=CC(=CC=C1NC(=O)CN)Br

InChI

InChI=1S/C8H9BrN2O/c9-6-1-3-7(4-2-6)11-8(12)5-10/h1-4H,5,10H2,(H,11,12)

InChIKey

AXRMYSHRBDXGGO-UHFFFAOYSA-N

Compound name

2-amino-N-(4-bromophenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 12
References: 0
Patents: 227.98982 Da
Monoisotopic Mass: 1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	228.99710	141.0
[M+Na]+	250.97904	142.7
[M+NH4]+	246.02364	145.5
[M+K]+	266.95298	143.2
[M-H]-	226.98254	142.1
[M+Na-2H]-	248.96449	144.4
[M]+	227.98927	140.2
[M]-	227.99037	140.2

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.