CID 156890

77303-19-6

Structural Information

Molecular Formula
C14H13N3O2
SMILES
COC1=CC(=C(C=C1)C2=NC3=C(N2)C=CC=N3)OC
InChI
InChI=1S/C14H13N3O2/c1-18-9-5-6-10(12(8-9)19-2)13-16-11-4-3-7-15-14(11)17-13/h3-8H,1-2H3,(H,15,16,17)
InChIKey
XQRDAEMFUZSXOO-UHFFFAOYSA-N
Compound name
2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

23
Patents

255.10077 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.10805 156.3
[M+Na]+ 278.08999 167.4
[M-H]- 254.09349 159.8
[M+NH4]+ 273.13459 171.6
[M+K]+ 294.06393 162.4
[M+H-H2O]+ 238.09803 147.3
[M+HCOO]- 300.09897 177.5
[M+CH3COO]- 314.11462 168.7
[M+Na-2H]- 276.07544 162.9
[M]+ 255.10022 160.0
[M]- 255.10132 160.0
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

No patent data available for this compound.