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]+ 235.034936 145.0
[M+Na]+ 257.016878 155.2
[M-H]- 233.020384 150.9
[M+NH4]+ 252.061483 161.3
[M+K]+ 272.990818 154.3
[M+H-H2O]+ 217.024920 139.4
[M+HCOO]- 279.025861 163.2
[M+CH3COO]- 293.041511 158.3
[M+Na-2H]- 255.002326 148.0
[M]+ 234.02711142 146.0
[M]- 234.02820858 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.