CID 45791889

7-fluoroquinoxaline-5-carboxylic acid

Structural Information

Molecular Formula
C9H5FN2O2
SMILES
C1=CN=C2C(=CC(=CC2=N1)F)C(=O)O
InChI
InChI=1S/C9H5FN2O2/c10-5-3-6(9(13)14)8-7(4-5)11-1-2-12-8/h1-4H,(H,13,14)
InChIKey
IKEZHSGHMHHGMC-UHFFFAOYSA-N
Compound name
7-fluoroquinoxaline-5-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.03351 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.04079 137.1
[M+Na]+ 215.02273 150.5
[M+NH4]+ 210.06733 144.3
[M+K]+ 230.99667 144.9
[M-H]- 191.02623 136.6
[M+Na-2H]- 213.00818 143.3
[M]+ 192.03296 138.7
[M]- 192.03406 138.7
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.