CID 28740457

2-(2-oxoimidazolidin-1-yl)benzoic acid

Structural Information

Molecular Formula
C10H10N2O3
SMILES
C1CN(C(=O)N1)C2=CC=CC=C2C(=O)O
InChI
InChI=1S/C10H10N2O3/c13-9(14)7-3-1-2-4-8(7)12-6-5-11-10(12)15/h1-4H,5-6H2,(H,11,15)(H,13,14)
InChIKey
LYTVFBGCZLRWKD-UHFFFAOYSA-N
Compound name
2-(2-oxoimidazolidin-1-yl)benzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

206.06914 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.07642 144.9
[M+Na]+ 229.05836 155.2
[M+NH4]+ 224.10296 150.9
[M+K]+ 245.03230 152.9
[M-H]- 205.06186 144.9
[M+Na-2H]- 227.04381 149.3
[M]+ 206.06859 145.9
[M]- 206.06969 145.9
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

patents stripe