CID 67424263

1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione

Structural Information

Molecular Formula
C5H5F3N2O2
SMILES
C1C(=O)NC(=O)N1CC(F)(F)F
InChI
InChI=1S/C5H5F3N2O2/c6-5(7,8)2-10-1-3(11)9-4(10)12/h1-2H2,(H,9,11,12)
InChIKey
GRNKNSZRBFNORR-UHFFFAOYSA-N
Compound name
1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

182.03032 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.03760 131.8
[M+Na]+ 205.01954 141.2
[M-H]- 181.02304 127.8
[M+NH4]+ 200.06414 150.3
[M+K]+ 220.99348 138.9
[M+H-H2O]+ 165.02758 123.7
[M+HCOO]- 227.02852 147.4
[M+CH3COO]- 241.04417 175.3
[M+Na-2H]- 203.00499 134.9
[M]+ 182.02977 125.3
[M]- 182.03087 125.3
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