CID 577206

1-(1h-imidazo[4,5-c]pyridin-4-yl)ethanone

Structural Information

Molecular Formula
C8H7N3O
SMILES
CC(=O)C1=NC=CC2=C1N=CN2
InChI
InChI=1S/C8H7N3O/c1-5(12)7-8-6(2-3-9-7)10-4-11-8/h2-4H,1H3,(H,10,11)
InChIKey
WTOOGKIOBGXDDY-UHFFFAOYSA-N
Compound name
1-(1H-imidazo[4,5-c]pyridin-4-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

161.05891 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.06619 130.9
[M+Na]+ 184.04813 141.7
[M-H]- 160.05163 130.9
[M+NH4]+ 179.09273 150.0
[M+K]+ 200.02207 138.3
[M+H-H2O]+ 144.05617 123.6
[M+HCOO]- 206.05711 151.9
[M+CH3COO]- 220.07276 144.5
[M+Na-2H]- 182.03358 138.7
[M]+ 161.05836 131.6
[M]- 161.05946 131.6
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