CID 9554204

Ar 2424

Structural Information

Molecular Formula
C9H9N3O5S
SMILES
CS(=O)(=O)C1=CC=C(O1)/C=N/N2CC(=O)NC2=O
InChI
InChI=1S/C9H9N3O5S/c1-18(15,16)8-3-2-6(17-8)4-10-12-5-7(13)11-9(12)14/h2-4H,5H2,1H3,(H,11,13,14)/b10-4+
InChIKey
HUYDXGZANYROHO-ONNFQVAWSA-N
Compound name
1-[(E)-(5-methylsulfonylfuran-2-yl)methylideneamino]imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.0263 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.03358 159.6
[M+Na]+ 294.01552 167.1
[M+NH4]+ 289.06012 163.7
[M+K]+ 309.98946 166.8
[M-H]- 270.01902 159.4
[M+Na-2H]- 292.00097 160.9
[M]+ 271.02575 160.5
[M]- 271.02685 160.5
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.