CID 342999

909768-32-7

Structural Information

Molecular Formula

C₈H₈BrN₃O

SMILES

CC(C1=NC2=C(N1)C=C(C=N2)Br)O

InChI

InChI=1S/C8H8BrN3O/c1-4(13)7-11-6-2-5(9)3-10-8(6)12-7/h2-4,13H,1H3,(H,10,11,12)

InChIKey

FZDJGAPRDIWTCF-UHFFFAOYSA-N

Compound name

1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 240.98508 Da
Monoisotopic Mass: 1.0
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]+	241.99236	147.2
[M+Na]+	263.97430	150.6
[M+NH4]+	259.01890	150.9
[M+K]+	279.94824	152.8
[M-H]-	239.97780	145.5
[M+Na-2H]-	261.95975	149.1
[M]+	240.98453	145.9
[M]-	240.98563	145.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe