CID 83869343

1427411-54-8

Structural Information

Molecular Formula
C11H11ClN2O2
SMILES
CC(C)C1=NC(=C2N1C=C(C=C2)Cl)C(=O)O
InChI
InChI=1S/C11H11ClN2O2/c1-6(2)10-13-9(11(15)16)8-4-3-7(12)5-14(8)10/h3-6H,1-2H3,(H,15,16)
InChIKey
WXXQONILZGGSQL-UHFFFAOYSA-N
Compound name
6-chloro-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.0509 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.05818 148.6
[M+Na]+ 261.04012 160.2
[M-H]- 237.04362 150.2
[M+NH4]+ 256.08472 167.2
[M+K]+ 277.01406 155.5
[M+H-H2O]+ 221.04816 142.7
[M+HCOO]- 283.04910 164.4
[M+CH3COO]- 297.06475 189.5
[M+Na-2H]- 259.02557 151.9
[M]+ 238.05035 153.4
[M]- 238.05145 153.4
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.