CID 363935

4,5,6,7-tetrahydro-1h-imidazo[4,5-c]pyridine-6-carboxylic acid

Structural Information

Molecular Formula
C7H9N3O2
SMILES
C1C(NCC2=C1N=CN2)C(=O)O
InChI
InChI=1S/C7H9N3O2/c11-7(12)5-1-4-6(2-8-5)10-3-9-4/h3,5,8H,1-2H2,(H,9,10)(H,11,12)
InChIKey
YCFJXOFFQLPCHD-UHFFFAOYSA-N
Compound name
4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

14
References

930
Patents

167.06947 Da
Monoisotopic Mass

-3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.07675 135.0
[M+Na]+ 190.05869 144.2
[M+NH4]+ 185.10329 141.3
[M+K]+ 206.03263 142.5
[M-H]- 166.06219 132.7
[M+Na-2H]- 188.04414 137.2
[M]+ 167.06892 135.1
[M]- 167.07002 135.1
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