CID 57360976

Ethyl 1-formylimidazo[1,5-a]pyridine-3-carboxylate

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

218.06914 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.07642 144.4
[M+Na]+ 241.05836 155.4
[M-H]- 217.06186 147.2
[M+NH4]+ 236.10296 163.4
[M+K]+ 257.03230 152.8
[M+H-H2O]+ 201.06640 137.2
[M+HCOO]- 263.06734 167.8
[M+CH3COO]- 277.08299 186.7
[M+Na-2H]- 239.04381 150.6
[M]+ 218.06859 150.0
[M]- 218.06969 150.0
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