CID 10567382

Ethyl 3-iodoimidazo[1,2-a]pyridine-2-carboxylate

Structural Information

Molecular Formula
C10H9IN2O2
SMILES
CCOC(=O)C1=C(N2C=CC=CC2=N1)I
InChI
InChI=1S/C10H9IN2O2/c1-2-15-10(14)8-9(11)13-6-4-3-5-7(13)12-8/h3-6H,2H2,1H3
InChIKey
JVTBABJAZWPLGS-UHFFFAOYSA-N
Compound name
ethyl 3-iodoimidazo[1,2-a]pyridine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

315.9709 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.97818 146.1
[M+Na]+ 338.96012 149.8
[M-H]- 314.96362 141.8
[M+NH4]+ 334.00472 160.6
[M+K]+ 354.93406 153.1
[M+H-H2O]+ 298.96816 135.6
[M+HCOO]- 360.96910 164.2
[M+CH3COO]- 374.98475 193.6
[M+Na-2H]- 336.94557 140.8
[M]+ 315.97035 147.9
[M]- 315.97145 147.9
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