CID 71756093

Methyl 3-(2,4-dioxoimidazolidin-1-yl)benzoate

Structural Information

Molecular Formula
C11H10N2O4
SMILES
COC(=O)C1=CC(=CC=C1)N2CC(=O)NC2=O
InChI
InChI=1S/C11H10N2O4/c1-17-10(15)7-3-2-4-8(5-7)13-6-9(14)12-11(13)16/h2-5H,6H2,1H3,(H,12,14,16)
InChIKey
DRBFQCUKWOOBOL-UHFFFAOYSA-N
Compound name
methyl 3-(2,4-dioxoimidazolidin-1-yl)benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

234.06406 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.07134 148.7
[M+Na]+ 257.05328 157.1
[M-H]- 233.05678 151.9
[M+NH4]+ 252.09788 164.8
[M+K]+ 273.02722 154.3
[M+H-H2O]+ 217.06132 141.2
[M+HCOO]- 279.06226 168.2
[M+CH3COO]- 293.07791 186.0
[M+Na-2H]- 255.03873 150.2
[M]+ 234.06351 147.9
[M]- 234.06461 147.9
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.