CID 76034217

3-[(2-nitrophenyl)methylideneamino]imidazolidine-2,4-dione

Structural Information

Molecular Formula
C10H8N4O4
SMILES
C1C(=O)N(C(=O)N1)N=CC2=CC=CC=C2[N+](=O)[O-]
InChI
InChI=1S/C10H8N4O4/c15-9-6-11-10(16)13(9)12-5-7-3-1-2-4-8(7)14(17)18/h1-5H,6H2,(H,11,16)
InChIKey
VSOZEYRXXBLHJE-UHFFFAOYSA-N
Compound name
3-[(2-nitrophenyl)methylideneamino]imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

248.05455 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.061826 150.2
[M+Na]+ 271.043768 157.1
[M-H]- 247.047274 154.8
[M+NH4]+ 266.088373 165.0
[M+K]+ 287.017708 150.0
[M+H-H2O]+ 231.051810 146.4
[M+HCOO]- 293.052751 174.2
[M+CH3COO]- 307.068401 186.2
[M+Na-2H]- 269.029216 156.4
[M]+ 248.05400142 146.3
[M]- 248.05509858 146.3
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.