CID 45088717

Imidazo[1,5-a]pyridine-8-carboxylic acid

Structural Information

Molecular Formula
C8H6N2O2
SMILES
C1=CN2C=NC=C2C(=C1)C(=O)O
InChI
InChI=1S/C8H6N2O2/c11-8(12)6-2-1-3-10-5-9-4-7(6)10/h1-5H,(H,11,12)
InChIKey
ZGKISOIXEAIYMJ-UHFFFAOYSA-N
Compound name
imidazo[1,5-a]pyridine-8-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

58
Patents

162.04292 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.05020 129.0
[M+Na]+ 185.03214 139.8
[M-H]- 161.03564 130.6
[M+NH4]+ 180.07674 149.4
[M+K]+ 201.00608 137.1
[M+H-H2O]+ 145.04018 122.5
[M+HCOO]- 207.04112 151.6
[M+CH3COO]- 221.05677 173.4
[M+Na-2H]- 183.01759 137.1
[M]+ 162.04237 130.7
[M]- 162.04347 130.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe