CID 16226888

929973-22-8

Structural Information

Molecular Formula
C10H6N2O5
SMILES
C1OC2=C(O1)C=C(C=C2)N3C(=O)C(=O)NC3=O
InChI
InChI=1S/C10H6N2O5/c13-8-9(14)12(10(15)11-8)5-1-2-6-7(3-5)17-4-16-6/h1-3H,4H2,(H,11,13,15)
InChIKey
SQBBGMCJXAASII-UHFFFAOYSA-N
Compound name
1-(1,3-benzodioxol-5-yl)imidazolidine-2,4,5-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

234.02766 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.03494 145.0
[M+Na]+ 257.01688 155.2
[M-H]- 233.02038 150.9
[M+NH4]+ 252.06148 161.3
[M+K]+ 272.99082 154.3
[M+H-H2O]+ 217.02492 139.4
[M+HCOO]- 279.02586 163.2
[M+CH3COO]- 293.04151 158.3
[M+Na-2H]- 255.00233 148.0
[M]+ 234.02711 146.0
[M]- 234.02821 146.0
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.