CID 129966153

2-bromo-1-{2,6-dimethylimidazo[1,2-a]pyridin-3-yl}ethan-1-one hydrobromide

Structural Information

Molecular Formula

C₁₁H₁₁BrN₂O

SMILES

CC1=CN2C(=NC(=C2C(=O)CBr)C)C=C1

InChI

InChI=1S/C11H11BrN2O/c1-7-3-4-10-13-8(2)11(9(15)5-12)14(10)6-7/h3-4,6H,5H2,1-2H3

InChIKey

TZUHXIJLFDLSIY-UHFFFAOYSA-N

Compound name

2-bromo-1-(2,6-dimethylimidazo[1,2-a]pyridin-3-yl)ethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 266.0055 Da
Monoisotopic Mass: 3.3
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]+	267.012776	149.8
[M+Na]+	288.994718	164.4
[M-H]-	264.998224	155.5
[M+NH4]+	284.039323	171.0
[M+K]+	304.968658	153.0
[M+H-H2O]+	249.002760	149.4
[M+HCOO]-	311.003701	170.3
[M+CH3COO]-	325.019351	194.9
[M+Na-2H]-	286.980166	156.2
[M]+	266.00495142	172.1
[M]-	266.00604858	172.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.