CID 46839982

Imidazo[1,2-a]pyridin-3-yl-oxoacetic acid ethyl ester

Structural Information

Molecular Formula
C11H10N2O3
SMILES
CCOC(=O)C(=O)C1=CN=C2N1C=CC=C2
InChI
InChI=1S/C11H10N2O3/c1-2-16-11(15)10(14)8-7-12-9-5-3-4-6-13(8)9/h3-7H,2H2,1H3
InChIKey
GTTUUUVRWZJOER-UHFFFAOYSA-N
Compound name
ethyl 2-imidazo[1,2-a]pyridin-3-yl-2-oxoacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

218.06914 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.076416 144.9
[M+Na]+ 241.058358 154.6
[M-H]- 217.061864 147.4
[M+NH4]+ 236.102963 163.5
[M+K]+ 257.032298 152.5
[M+H-H2O]+ 201.066400 137.5
[M+HCOO]- 263.067341 167.3
[M+CH3COO]- 277.082991 186.4
[M+Na-2H]- 239.043806 150.6
[M]+ 218.06859142 149.4
[M]- 218.06968858 149.4
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

patents stripe