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 157.4
[M+Na]+ 294.01552 167.2
[M-H]- 270.01902 163.4
[M+NH4]+ 289.06012 173.5
[M+K]+ 309.98946 165.6
[M+H-H2O]+ 254.02356 151.7
[M+HCOO]- 316.02450 175.0
[M+CH3COO]- 330.04015 191.9
[M+Na-2H]- 292.00097 158.6
[M]+ 271.02575 160.8
[M]- 271.02685 160.8
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.