CID 71306130

1126636-89-2

Structural Information

Molecular Formula

C₁₀H₈N₂O₃

SMILES

COC(=O)C1=CN2C(=NC=C2C=O)C=C1

InChI

InChI=1S/C10H8N2O3/c1-15-10(14)7-2-3-9-11-4-8(6-13)12(9)5-7/h2-6H,1H3

InChIKey

XOISSYVAJVWIDN-UHFFFAOYSA-N

Compound name

methyl 3-formylimidazo[1,2-a]pyridine-6-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 204.0535 Da
Monoisotopic Mass: 1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	205.06078	141.0
[M+Na]+	227.04272	154.3
[M+NH4]+	222.08732	148.1
[M+K]+	243.01666	150.6
[M-H]-	203.04622	141.0
[M+Na-2H]-	225.02817	146.7
[M]+	204.05295	142.7
[M]-	204.05405	142.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe