CID 13259030

88571-07-7

Structural Information

Molecular Formula
C17H16ClN3O2
SMILES
CCOC(=O)CC1=C(N=C2N1C=C(C=C2)C)C3=NC=C(C=C3)Cl
InChI
InChI=1S/C17H16ClN3O2/c1-3-23-16(22)8-14-17(13-6-5-12(18)9-19-13)20-15-7-4-11(2)10-21(14)15/h4-7,9-10H,3,8H2,1-2H3
InChIKey
DYGAQLHSEFUWEU-UHFFFAOYSA-N
Compound name
ethyl 2-[2-(5-chloropyridin-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.0931 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.10038 174.9
[M+Na]+ 352.08232 191.5
[M+NH4]+ 347.12692 182.3
[M+K]+ 368.05626 185.0
[M-H]- 328.08582 177.7
[M+Na-2H]- 350.06777 182.5
[M]+ 329.09255 178.4
[M]- 329.09365 178.4
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.