CID 13259032

88571-09-9

Structural Information

Molecular Formula
C18H19N3O2
SMILES
CCOC(=O)CC1=C(N=C2N1C=C(C=C2)C)C3=NC=C(C=C3)C
InChI
InChI=1S/C18H19N3O2/c1-4-23-17(22)9-15-18(14-7-5-12(2)10-19-14)20-16-8-6-13(3)11-21(15)16/h5-8,10-11H,4,9H2,1-3H3
InChIKey
NXOMLXXCUZEELS-UHFFFAOYSA-N
Compound name
ethyl 2-[6-methyl-2-(5-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.14774 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.155016 174.2
[M+Na]+ 332.136958 184.9
[M-H]- 308.140464 178.9
[M+NH4]+ 327.181563 188.2
[M+K]+ 348.110898 179.7
[M+H-H2O]+ 292.145000 164.5
[M+HCOO]- 354.145941 194.7
[M+CH3COO]- 368.161591 207.4
[M+Na-2H]- 330.122406 177.2
[M]+ 309.14719142 180.1
[M]- 309.14828858 180.1
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.