CID 9577282

Afmai

Structural Information

Molecular Formula
C8H8N4O3
SMILES
C1C(=O)NC(=O)N1/N=C/C2=CC=C(O2)N
InChI
InChI=1S/C8H8N4O3/c9-6-2-1-5(15-6)3-10-12-4-7(13)11-8(12)14/h1-3H,4,9H2,(H,11,13,14)/b10-3+
InChIKey
KLJOOBXQOIHZQM-XCVCLJGOSA-N
Compound name
1-[(E)-(5-aminofuran-2-yl)methylideneamino]imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

2
Patents

208.05965 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.06693 141.6
[M+Na]+ 231.04887 150.1
[M-H]- 207.05237 146.7
[M+NH4]+ 226.09347 159.1
[M+K]+ 247.02281 148.6
[M+H-H2O]+ 191.05691 134.1
[M+HCOO]- 253.05785 165.6
[M+CH3COO]- 267.07350 186.4
[M+Na-2H]- 229.03432 144.5
[M]+ 208.05910 139.7
[M]- 208.06020 139.7
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.