CID 16227744

2-(2-oxo-6-sulfamoyl-2,3-dihydro-1,3-benzoxazol-3-yl)acetic acid

Structural Information

Molecular Formula
C9H8N2O6S
SMILES
C1=CC2=C(C=C1S(=O)(=O)N)OC(=O)N2CC(=O)O
InChI
InChI=1S/C9H8N2O6S/c10-18(15,16)5-1-2-6-7(3-5)17-9(14)11(6)4-8(12)13/h1-3H,4H2,(H,12,13)(H2,10,15,16)
InChIKey
BMGRDOBVZXLURN-UHFFFAOYSA-N
Compound name
2-(2-oxo-6-sulfamoyl-1,3-benzoxazol-3-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.0103 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.01758 155.5
[M+Na]+ 294.99952 165.2
[M+NH4]+ 290.04412 160.0
[M+K]+ 310.97346 163.5
[M-H]- 271.00302 154.7
[M+Na-2H]- 292.98497 157.2
[M]+ 272.00975 156.7
[M]- 272.01085 156.7
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.