CID 2064134

2-chloroimidazo[1,2-a]pyridine-3-carbaldehyde

Structural Information

Molecular Formula
C8H5ClN2O
SMILES
C1=CC2=NC(=C(N2C=C1)C=O)Cl
InChI
InChI=1S/C8H5ClN2O/c9-8-6(5-12)11-4-2-1-3-7(11)10-8/h1-5H
InChIKey
FVRORAWYCXIWSN-UHFFFAOYSA-N
Compound name
2-chloroimidazo[1,2-a]pyridine-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

24
Patents

180.00903 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.016306 131.6
[M+Na]+ 202.998248 144.8
[M-H]- 179.001754 134.4
[M+NH4]+ 198.042853 153.2
[M+K]+ 218.972188 140.2
[M+H-H2O]+ 163.006290 125.4
[M+HCOO]- 225.007231 151.7
[M+CH3COO]- 239.022881 146.7
[M+Na-2H]- 200.983696 139.9
[M]+ 180.00848142 136.5
[M]- 180.00957858 136.5
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