CID 130046763

2411227-70-6

Structural Information

Molecular Formula

C₁₀H₉BrN₂O₂

SMILES

CCC1=C(N=C2N1C=CC=C2Br)C(=O)O

InChI

InChI=1S/C10H9BrN2O2/c1-2-7-8(10(14)15)12-9-6(11)4-3-5-13(7)9/h3-5H,2H2,1H3,(H,14,15)

InChIKey

SHSXVXFOPOLCGX-UHFFFAOYSA-N

Compound name

8-bromo-3-ethylimidazo[1,2-a]pyridine-2-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 267.98474 Da
Monoisotopic Mass: 3.1
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]+	268.992016	148.6
[M+Na]+	290.973958	163.0
[M-H]-	266.977464	153.2
[M+NH4]+	286.018563	169.0
[M+K]+	306.947898	151.5
[M+H-H2O]+	250.982000	148.4
[M+HCOO]-	312.982941	168.2
[M+CH3COO]-	326.998591	191.7
[M+Na-2H]-	288.959406	155.1
[M]+	267.98419142	170.2
[M]-	267.98528858	170.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.