CID 4875367

5-methyl-5-[4-(propan-2-yl)phenyl]imidazolidine-2,4-dione

Structural Information

Molecular Formula
C13H16N2O2
SMILES
CC(C)C1=CC=C(C=C1)C2(C(=O)NC(=O)N2)C
InChI
InChI=1S/C13H16N2O2/c1-8(2)9-4-6-10(7-5-9)13(3)11(16)14-12(17)15-13/h4-8H,1-3H3,(H2,14,15,16,17)
InChIKey
OPZJJCAJHFRRSI-UHFFFAOYSA-N
Compound name
5-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

232.12119 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.12847 152.7
[M+Na]+ 255.11041 160.8
[M-H]- 231.11391 154.6
[M+NH4]+ 250.15501 170.5
[M+K]+ 271.08435 156.4
[M+H-H2O]+ 215.11845 146.2
[M+HCOO]- 277.11939 169.6
[M+CH3COO]- 291.13504 186.2
[M+Na-2H]- 253.09586 153.8
[M]+ 232.12064 149.1
[M]- 232.12174 149.1
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