CID 13625463

Ethyl 2-{3h-imidazo[4,5-b]pyridin-2-yl}acetate

Structural Information

Molecular Formula
C10H11N3O2
SMILES
CCOC(=O)CC1=NC2=C(N1)C=CC=N2
InChI
InChI=1S/C10H11N3O2/c1-2-15-9(14)6-8-12-7-4-3-5-11-10(7)13-8/h3-5H,2,6H2,1H3,(H,11,12,13)
InChIKey
MBJLVQKGFDSQGA-UHFFFAOYSA-N
Compound name
ethyl 2-(1H-imidazo[4,5-b]pyridin-2-yl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

106
Patents

205.08513 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.09241 143.3
[M+Na]+ 228.07435 153.1
[M-H]- 204.07785 143.0
[M+NH4]+ 223.11895 160.5
[M+K]+ 244.04829 149.8
[M+H-H2O]+ 188.08239 135.4
[M+HCOO]- 250.08333 163.8
[M+CH3COO]- 264.09898 181.6
[M+Na-2H]- 226.05980 150.0
[M]+ 205.08458 146.0
[M]- 205.08568 146.0
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