CID 16227782

930395-71-4

Structural Information

Molecular Formula
C13H15N3O2
SMILES
C1CCN(C1)CC2=CN3C=CC=C(C3=N2)C(=O)O
InChI
InChI=1S/C13H15N3O2/c17-13(18)11-4-3-7-16-9-10(14-12(11)16)8-15-5-1-2-6-15/h3-4,7,9H,1-2,5-6,8H2,(H,17,18)
InChIKey
IGLXARCHGFRGSR-UHFFFAOYSA-N
Compound name
2-(pyrrolidin-1-ylmethyl)imidazo[1,2-a]pyridine-8-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

245.11642 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.12370 154.5
[M+Na]+ 268.10564 162.9
[M-H]- 244.10914 157.5
[M+NH4]+ 263.15024 171.6
[M+K]+ 284.07958 159.1
[M+H-H2O]+ 228.11368 146.2
[M+HCOO]- 290.11462 173.4
[M+CH3COO]- 304.13027 166.2
[M+Na-2H]- 266.09109 156.4
[M]+ 245.11587 154.3
[M]- 245.11697 154.3
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.