CID 79816104

1507137-28-1

Structural Information

Molecular Formula
C12H16N4O2
SMILES
CCOC(=O)CC1=NC2=C(N1)C=CC(=N2)N(C)C
InChI
InChI=1S/C12H16N4O2/c1-4-18-11(17)7-9-13-8-5-6-10(16(2)3)15-12(8)14-9/h5-6H,4,7H2,1-3H3,(H,13,14,15)
InChIKey
WRIFYPOJQJLFNU-UHFFFAOYSA-N
Compound name
ethyl 2-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

248.12732 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.13460 155.3
[M+Na]+ 271.11654 166.6
[M+NH4]+ 266.16114 161.3
[M+K]+ 287.09048 163.7
[M-H]- 247.12004 155.1
[M+Na-2H]- 269.10199 159.9
[M]+ 248.12677 156.5
[M]- 248.12787 156.5
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.