CID 682232

Ethyl 2,7-dimethylimidazo[1,2-a]pyridine-3-carboxylate

Structural Information

Molecular Formula
C12H14N2O2
SMILES
CCOC(=O)C1=C(N=C2N1C=CC(=C2)C)C
InChI
InChI=1S/C12H14N2O2/c1-4-16-12(15)11-9(3)13-10-7-8(2)5-6-14(10)11/h5-7H,4H2,1-3H3
InChIKey
CQNUHMHESISBRX-UHFFFAOYSA-N
Compound name
ethyl 2,7-dimethylimidazo[1,2-a]pyridine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

11
References

83
Patents

218.10553 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.112806 147.1
[M+Na]+ 241.094748 158.4
[M-H]- 217.098254 150.1
[M+NH4]+ 236.139353 166.6
[M+K]+ 257.068688 155.7
[M+H-H2O]+ 201.102790 140.2
[M+HCOO]- 263.103731 169.8
[M+CH3COO]- 277.119381 189.7
[M+Na-2H]- 239.080196 152.0
[M]+ 218.10498142 152.8
[M]- 218.10607858 152.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe