CID 4098428

5-(2-phenylethyl)imidazolidine-2,4-dione

Structural Information

Molecular Formula
C11H12N2O2
SMILES
C1=CC=C(C=C1)CCC2C(=O)NC(=O)N2
InChI
InChI=1S/C11H12N2O2/c14-10-9(12-11(15)13-10)7-6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H2,12,13,14,15)
InChIKey
WADHXSHSHULALT-UHFFFAOYSA-N
Compound name
5-(2-phenylethyl)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

82
Patents

204.08987 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.097146 145.0
[M+Na]+ 227.079088 152.3
[M-H]- 203.082594 146.3
[M+NH4]+ 222.123693 161.6
[M+K]+ 243.053028 147.5
[M+H-H2O]+ 187.087130 137.5
[M+HCOO]- 249.088071 163.5
[M+CH3COO]- 263.103721 178.5
[M+Na-2H]- 225.064536 147.7
[M]+ 204.08932142 140.5
[M]- 204.09041858 140.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe