CID 2560682

852389-17-4

Structural Information

Molecular Formula
C10H7FN2O4
SMILES
C1=CC(=CC=C1C2=NN(C(=O)O2)CC(=O)O)F
InChI
InChI=1S/C10H7FN2O4/c11-7-3-1-6(2-4-7)9-12-13(5-8(14)15)10(16)17-9/h1-4H,5H2,(H,14,15)
InChIKey
MWVSPYYEJYTGJS-UHFFFAOYSA-N
Compound name
2-[5-(4-fluorophenyl)-2-oxo-1,3,4-oxadiazol-3-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

238.03899 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.04627 149.4
[M+Na]+ 261.02821 161.3
[M+NH4]+ 256.07281 154.4
[M+K]+ 277.00215 159.4
[M-H]- 237.03171 149.6
[M+Na-2H]- 259.01366 154.1
[M]+ 238.03844 150.8
[M]- 238.03954 150.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.