CID 129851

70842-04-5

Structural Information

Molecular Formula
C12H10F4N2O2
SMILES
CC1(C(=O)N(C(=O)N1)C2=CC(=C(C=C2)F)C(F)(F)F)C
InChI
InChI=1S/C12H10F4N2O2/c1-11(2)9(19)18(10(20)17-11)6-3-4-8(13)7(5-6)12(14,15)16/h3-5H,1-2H3,(H,17,20)
InChIKey
BTGSGTWRNQCEQY-UHFFFAOYSA-N
Compound name
3-[4-fluoro-3-(trifluoromethyl)phenyl]-5,5-dimethylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

38
Patents

290.06784 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.07512 157.7
[M+Na]+ 313.05706 169.3
[M-H]- 289.06056 156.5
[M+NH4]+ 308.10166 174.3
[M+K]+ 329.03100 164.2
[M+H-H2O]+ 273.06510 148.5
[M+HCOO]- 335.06604 171.4
[M+CH3COO]- 349.08169 198.0
[M+Na-2H]- 311.04251 158.3
[M]+ 290.06729 151.8
[M]- 290.06839 151.8
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