CID 5311906

3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C8H5FN2O2
SMILES
C1=CC2=NC(=C(N2C=C1)F)C(=O)O
InChI
InChI=1S/C8H5FN2O2/c9-7-6(8(12)13)10-5-3-1-2-4-11(5)7/h1-4H,(H,12,13)
InChIKey
RPGXDJQIUNYMAG-UHFFFAOYSA-N
Compound name
3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

180.03351 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.040786 131.2
[M+Na]+ 203.022728 142.9
[M-H]- 179.026234 131.7
[M+NH4]+ 198.067333 151.1
[M+K]+ 218.996668 139.7
[M+H-H2O]+ 163.030770 124.0
[M+HCOO]- 225.031711 152.7
[M+CH3COO]- 239.047361 177.3
[M+Na-2H]- 201.008176 138.0
[M]+ 180.03296142 132.2
[M]- 180.03405858 132.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe