CID 12674617

2138523-42-7

Structural Information

Molecular Formula
C7H5N3O2
SMILES
C1=CN2C=C(N=C2C=N1)C(=O)O
InChI
InChI=1S/C7H5N3O2/c11-7(12)5-4-10-2-1-8-3-6(10)9-5/h1-4H,(H,11,12)
InChIKey
KVRLBPBHYUWTAR-UHFFFAOYSA-N
Compound name
imidazo[1,2-a]pyrazine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

93
Patents

163.03818 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.04546 129.1
[M+Na]+ 186.02740 140.2
[M-H]- 162.03090 129.3
[M+NH4]+ 181.07200 148.0
[M+K]+ 202.00134 137.6
[M+H-H2O]+ 146.03544 121.8
[M+HCOO]- 208.03638 150.6
[M+CH3COO]- 222.05203 143.0
[M+Na-2H]- 184.01285 137.5
[M]+ 163.03763 130.9
[M]- 163.03873 130.9
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