CID 79015415

1267751-21-2

Structural Information

Molecular Formula
C12H14N2O2
SMILES
CC(C)(C)C1=C(N2C=CC=CC2=N1)C(=O)O
InChI
InChI=1S/C12H14N2O2/c1-12(2,3)10-9(11(15)16)14-7-5-4-6-8(14)13-10/h4-7H,1-3H3,(H,15,16)
InChIKey
HZCQOMODWMCZOS-UHFFFAOYSA-N
Compound name
2-tert-butylimidazo[1,2-a]pyridine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.10553 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.11281 148.9
[M+Na]+ 241.09475 159.2
[M-H]- 217.09825 150.5
[M+NH4]+ 236.13935 167.5
[M+K]+ 257.06869 156.1
[M+H-H2O]+ 201.10279 142.7
[M+HCOO]- 263.10373 168.5
[M+CH3COO]- 277.11938 186.3
[M+Na-2H]- 239.08020 154.8
[M]+ 218.10498 151.8
[M]- 218.10608 151.8
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.