CID 4780006

5-butyl-5-(4-fluorophenyl)imidazolidine-2,4-dione

Structural Information

Molecular Formula
C13H15FN2O2
SMILES
CCCCC1(C(=O)NC(=O)N1)C2=CC=C(C=C2)F
InChI
InChI=1S/C13H15FN2O2/c1-2-3-8-13(11(17)15-12(18)16-13)9-4-6-10(14)7-5-9/h4-7H,2-3,8H2,1H3,(H2,15,16,17,18)
InChIKey
NAVKQMFSENZTKK-UHFFFAOYSA-N
Compound name
5-butyl-5-(4-fluorophenyl)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.11176 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.11904 155.3
[M+Na]+ 273.10098 163.6
[M-H]- 249.10448 155.5
[M+NH4]+ 268.14558 172.3
[M+K]+ 289.07492 158.2
[M+H-H2O]+ 233.10902 147.5
[M+HCOO]- 295.10996 172.0
[M+CH3COO]- 309.12561 188.0
[M+Na-2H]- 271.08643 156.9
[M]+ 250.11121 151.1
[M]- 250.11231 151.1
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

No patent data available for this compound.