CID 3067500

Brn 5114296

Structural Information

Molecular Formula
C10H10N4O6S
SMILES
C1=CC(=CC=C1NC(=O)C(=O)N)S(=O)(=O)NC(=O)C(=O)N
InChI
InChI=1S/C10H10N4O6S/c11-7(15)9(17)13-5-1-3-6(4-2-5)21(19,20)14-10(18)8(12)16/h1-4H,(H2,11,15)(H2,12,16)(H,13,17)(H,14,18)
InChIKey
HGDOVWYSYNVFHZ-UHFFFAOYSA-N
Compound name
N'-[4-(oxamoylsulfamoyl)phenyl]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

314.0321 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.03938 164.7
[M+Na]+ 337.02132 168.6
[M-H]- 313.02482 166.9
[M+NH4]+ 332.06592 176.6
[M+K]+ 352.99526 167.2
[M+H-H2O]+ 297.02936 156.8
[M+HCOO]- 359.03030 182.5
[M+CH3COO]- 373.04595 208.6
[M+Na-2H]- 335.00677 165.7
[M]+ 314.03155 162.9
[M]- 314.03265 162.9
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.