CID 3047053

1-(3-chlorophenyl)-2,5-dioxo-4-imidazolidineacetic acid

Structural Information

Molecular Formula
C11H9ClN2O4
SMILES
C1=CC(=CC(=C1)Cl)N2C(=O)C(NC2=O)CC(=O)O
InChI
InChI=1S/C11H9ClN2O4/c12-6-2-1-3-7(4-6)14-10(17)8(5-9(15)16)13-11(14)18/h1-4,8H,5H2,(H,13,18)(H,15,16)
InChIKey
MGXOWLALRCYISZ-UHFFFAOYSA-N
Compound name
2-[1-(3-chlorophenyl)-2,5-dioxoimidazolidin-4-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.0251 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.03238 155.7
[M+Na]+ 291.01432 166.9
[M+NH4]+ 286.05892 161.0
[M+K]+ 306.98826 164.4
[M-H]- 267.01782 155.1
[M+Na-2H]- 288.99977 159.0
[M]+ 268.02455 156.9
[M]- 268.02565 156.9
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.