CID 62116824

2-cyclobutoxypyridine-4-carboxylic acid

Structural Information

Molecular Formula
C10H11NO3
SMILES
C1CC(C1)OC2=NC=CC(=C2)C(=O)O
InChI
InChI=1S/C10H11NO3/c12-10(13)7-4-5-11-9(6-7)14-8-2-1-3-8/h4-6,8H,1-3H2,(H,12,13)
InChIKey
UZGFTJROENGNCP-UHFFFAOYSA-N
Compound name
2-cyclobutyloxypyridine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

193.0739 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.08118 137.2
[M+Na]+ 216.06312 142.7
[M-H]- 192.06662 140.9
[M+NH4]+ 211.10772 147.8
[M+K]+ 232.03706 144.2
[M+H-H2O]+ 176.07116 124.8
[M+HCOO]- 238.07210 156.6
[M+CH3COO]- 252.08775 183.2
[M+Na-2H]- 214.04857 142.1
[M]+ 193.07335 145.1
[M]- 193.07445 145.1
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

patents stripe