CID 79821017

1507825-37-7

Structural Information

Molecular Formula
C11H14N4O2
SMILES
CCOC(=O)CC1=NC2=C(N1)C=CC(=N2)NC
InChI
InChI=1S/C11H14N4O2/c1-3-17-10(16)6-9-13-7-4-5-8(12-2)14-11(7)15-9/h4-5H,3,6H2,1-2H3,(H2,12,13,14,15)
InChIKey
CCWJWGMTCCOLAK-UHFFFAOYSA-N
Compound name
ethyl 2-[5-(methylamino)-1H-imidazo[4,5-b]pyridin-2-yl]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

234.11168 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.11896 151.4
[M+Na]+ 257.10090 160.8
[M-H]- 233.10440 151.3
[M+NH4]+ 252.14550 167.4
[M+K]+ 273.07484 157.2
[M+H-H2O]+ 217.10894 143.2
[M+HCOO]- 279.10988 172.6
[M+CH3COO]- 293.12553 190.8
[M+Na-2H]- 255.08635 157.5
[M]+ 234.11113 154.2
[M]- 234.11223 154.2
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.