CID 16413638

Methyl 6-chloroimidazo[1,2-a]pyridine-3-carboxylate

Structural Information

Molecular Formula
C9H7ClN2O2
SMILES
COC(=O)C1=CN=C2N1C=C(C=C2)Cl
InChI
InChI=1S/C9H7ClN2O2/c1-14-9(13)7-4-11-8-3-2-6(10)5-12(7)8/h2-5H,1H3
InChIKey
UFRZEIOOOFHTPS-UHFFFAOYSA-N
Compound name
methyl 6-chloroimidazo[1,2-a]pyridine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.0196 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.02688 139.4
[M+Na]+ 233.00882 151.8
[M-H]- 209.01232 142.2
[M+NH4]+ 228.05342 159.7
[M+K]+ 248.98276 148.0
[M+H-H2O]+ 193.01686 133.1
[M+HCOO]- 255.01780 158.4
[M+CH3COO]- 269.03345 183.3
[M+Na-2H]- 230.99427 146.0
[M]+ 210.01905 145.4
[M]- 210.02015 145.4
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

No patent data available for this compound.