CID 4738483

6-amino-3-bromopyridin-2-ol

Structural Information

Molecular Formula

C₅H₅BrN₂O

SMILES

C1=C(C(=O)NC(=C1)N)Br

InChI

InChI=1S/C5H5BrN2O/c6-3-1-2-4(7)8-5(3)9/h1-2H,(H3,7,8,9)

InChIKey

IMKHBQLYABVXBJ-UHFFFAOYSA-N

Compound name

6-amino-3-bromo-1H-pyridin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 187.95853 Da
Monoisotopic Mass: 0.6
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]+	188.96581	129.2
[M+Na]+	210.94775	132.4
[M+NH4]+	205.99235	133.6
[M+K]+	226.92169	133.2
[M-H]-	186.95125	129.2
[M+Na-2H]-	208.93320	132.7
[M]+	187.95798	128.3
[M]-	187.95908	128.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.