CID 51063797

6-(cyclobutylmethoxy)pyridine-2-carboxylic acid

Structural Information

Molecular Formula
C11H13NO3
SMILES
C1CC(C1)COC2=CC=CC(=N2)C(=O)O
InChI
InChI=1S/C11H13NO3/c13-11(14)9-5-2-6-10(12-9)15-7-8-3-1-4-8/h2,5-6,8H,1,3-4,7H2,(H,13,14)
InChIKey
KVHXNUQVENXOKS-UHFFFAOYSA-N
Compound name
6-(cyclobutylmethoxy)pyridine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.08954 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.09682 144.2
[M+Na]+ 230.07876 151.2
[M+NH4]+ 225.12336 147.4
[M+K]+ 246.05270 148.0
[M-H]- 206.08226 143.0
[M+Na-2H]- 228.06421 147.9
[M]+ 207.08899 143.4
[M]- 207.09009 143.4
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.