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-methylpyridin-2-yl)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]+ 310.15502 174.2
[M+Na]+ 332.13696 184.9
[M-H]- 308.14046 178.9
[M+NH4]+ 327.18156 188.2
[M+K]+ 348.11090 179.7
[M+H-H2O]+ 292.14500 164.5
[M+HCOO]- 354.14594 194.7
[M+CH3COO]- 368.16159 207.4
[M+Na-2H]- 330.12241 177.2
[M]+ 309.14719 180.1
[M]- 309.14829 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.