CID 243330

5-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione

Structural Information

Molecular Formula
C13H16N2O2
SMILES
CC(C)CC1(C(=O)NC(=O)N1)C2=CC=CC=C2
InChI
InChI=1S/C13H16N2O2/c1-9(2)8-13(10-6-4-3-5-7-10)11(16)14-12(17)15-13/h3-7,9H,8H2,1-2H3,(H2,14,15,16,17)
InChIKey
SYVOCCKCQWJPAH-UHFFFAOYSA-N
Compound name
5-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

1
Patents

232.12119 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.12847 153.4
[M+Na]+ 255.11041 160.5
[M-H]- 231.11391 154.8
[M+NH4]+ 250.15501 170.8
[M+K]+ 271.08435 156.1
[M+H-H2O]+ 215.11845 146.5
[M+HCOO]- 277.11939 170.2
[M+CH3COO]- 291.13504 185.0
[M+Na-2H]- 253.09586 155.1
[M]+ 232.12064 149.3
[M]- 232.12174 149.3
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