CID 12429097

4-amino-1-methyl-1h,2h,3h-imidazo[4,5-c]pyridin-2-one

Structural Information

Molecular Formula
C7H8N4O
SMILES
CN1C2=C(C(=NC=C2)N)NC1=O
InChI
InChI=1S/C7H8N4O/c1-11-4-2-3-9-6(8)5(4)10-7(11)12/h2-3H,1H3,(H2,8,9)(H,10,12)
InChIKey
IIPWPPGQGGYWHW-UHFFFAOYSA-N
Compound name
4-amino-1-methyl-3H-imidazo[4,5-c]pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

164.06981 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.077086 131.1
[M+Na]+ 187.059028 143.7
[M-H]- 163.062534 131.5
[M+NH4]+ 182.103633 150.2
[M+K]+ 203.032968 139.5
[M+H-H2O]+ 147.067070 124.2
[M+HCOO]- 209.068011 153.8
[M+CH3COO]- 223.083661 145.1
[M+Na-2H]- 185.044476 138.6
[M]+ 164.06926142 131.3
[M]- 164.07035858 131.3
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