CID 3070182

2-oxoimidazo(4,5-b)pyridine sodium salt

Structural Information

Molecular Formula
C6H7N3O
SMILES
C1C=CC2=C(N1)NC(=O)N2
InChI
InChI=1S/C6H7N3O/c10-6-8-4-2-1-3-7-5(4)9-6/h1-2,7H,3H2,(H2,8,9,10)
InChIKey
VRILUVOERATUBV-UHFFFAOYSA-N
Compound name
1,3,4,5-tetrahydroimidazo[4,5-b]pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

137.05891 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.06619 126.2
[M+Na]+ 160.04813 135.3
[M-H]- 136.05163 123.0
[M+NH4]+ 155.09273 144.7
[M+K]+ 176.02207 130.6
[M+H-H2O]+ 120.05617 119.6
[M+HCOO]- 182.05711 143.0
[M+CH3COO]- 196.07276 138.2
[M+Na-2H]- 158.03358 133.3
[M]+ 137.05836 120.4
[M]- 137.05946 120.4
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

No patent data available for this compound.