CID 5375700

5,6-dichloro-1h,2h,3h-imidazo[4,5-b]pyridin-2-one

Structural Information

Molecular Formula
C6H3Cl2N3O
SMILES
C1=C2C(=NC(=C1Cl)Cl)NC(=O)N2
InChI
InChI=1S/C6H3Cl2N3O/c7-2-1-3-5(10-4(2)8)11-6(12)9-3/h1H,(H2,9,10,11,12)
InChIKey
ITKBBOLEUZVKAE-UHFFFAOYSA-N
Compound name
5,6-dichloro-1,3-dihydroimidazo[4,5-b]pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.96532 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.97260 134.1
[M+Na]+ 225.95454 148.2
[M-H]- 201.95804 132.5
[M+NH4]+ 220.99914 152.5
[M+K]+ 241.92848 141.1
[M+H-H2O]+ 185.96258 128.4
[M+HCOO]- 247.96352 145.1
[M+CH3COO]- 261.97917 147.2
[M+Na-2H]- 223.93999 140.7
[M]+ 202.96477 136.1
[M]- 202.96587 136.1
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.