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]+ 138.066186 126.2
[M+Na]+ 160.048128 135.3
[M-H]- 136.051634 123.0
[M+NH4]+ 155.092733 144.7
[M+K]+ 176.022068 130.6
[M+H-H2O]+ 120.056170 119.6
[M+HCOO]- 182.057111 143.0
[M+CH3COO]- 196.072761 138.2
[M+Na-2H]- 158.033576 133.3
[M]+ 137.05836142 120.4
[M]- 137.05945858 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.