CID 13611623

106833-81-2

Structural Information

Molecular Formula
C8H5NO4
SMILES
C1=COC(=N1)C2=CC=C(O2)C(=O)O
InChI
InChI=1S/C8H5NO4/c10-8(11)6-2-1-5(13-6)7-9-3-4-12-7/h1-4H,(H,10,11)
InChIKey
IWNZUIQGYNGFIS-UHFFFAOYSA-N
Compound name
5-(1,3-oxazol-2-yl)furan-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.02185 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.02913 131.8
[M+Na]+ 202.01107 143.9
[M+NH4]+ 197.05567 138.7
[M+K]+ 217.98501 144.5
[M-H]- 178.01457 135.3
[M+Na-2H]- 199.99652 137.7
[M]+ 179.02130 134.3
[M]- 179.02240 134.3
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.