CID 10511867

2728384-60-7

Structural Information

Molecular Formula

C₁₀H₁₀N₂O₂

SMILES

C1=CC2=NC=C(N2C=C1)CCC(=O)O

InChI

InChI=1S/C10H10N2O2/c13-10(14)5-4-8-7-11-9-3-1-2-6-12(8)9/h1-3,6-7H,4-5H2,(H,13,14)

InChIKey

SYSGIRAGDWJRMW-UHFFFAOYSA-N

Compound name

3-imidazo[1,2-a]pyridin-3-ylpropanoic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 8
Patents: 190.07423 Da
Monoisotopic Mass: 1.6
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]+	191.08151	138.5
[M+Na]+	213.06345	148.3
[M-H]-	189.06695	139.6
[M+NH4]+	208.10805	157.7
[M+K]+	229.03739	145.1
[M+H-H2O]+	173.07149	131.5
[M+HCOO]-	235.07243	160.3
[M+CH3COO]-	249.08808	179.4
[M+Na-2H]-	211.04890	145.4
[M]+	190.07368	140.8
[M]-	190.07478	140.8

Literature stripe

literature stripe

Patent stripe

patents stripe