CID 21204129

[(4-sulfamoylphenyl)carbamoyl]formic acid

Structural Information

Molecular Formula
C8H8N2O5S
SMILES
C1=CC(=CC=C1NC(=O)C(=O)O)S(=O)(=O)N
InChI
InChI=1S/C8H8N2O5S/c9-16(14,15)6-3-1-5(2-4-6)10-7(11)8(12)13/h1-4H,(H,10,11)(H,12,13)(H2,9,14,15)
InChIKey
FOJRIMXMADGUPZ-UHFFFAOYSA-N
Compound name
2-oxo-2-(4-sulfamoylanilino)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.0154 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.02268 148.2
[M+Na]+ 267.00462 154.9
[M-H]- 243.00812 150.2
[M+NH4]+ 262.04922 163.9
[M+K]+ 282.97856 152.3
[M+H-H2O]+ 227.01266 141.9
[M+HCOO]- 289.01360 165.6
[M+CH3COO]- 303.02925 188.3
[M+Na-2H]- 264.99007 151.3
[M]+ 244.01485 148.0
[M]- 244.01595 148.0
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.