CID 3059465

Hydantoin, 5-phenyl-5-(alpha,alpha,alpha-trifluoro-m-tolyl)-

Structural Information

Molecular Formula
C16H11F3N2O2
SMILES
C1=CC=C(C=C1)C2(C(=O)NC(=O)N2)C3=CC(=CC=C3)C(F)(F)F
InChI
InChI=1S/C16H11F3N2O2/c17-16(18,19)12-8-4-7-11(9-12)15(10-5-2-1-3-6-10)13(22)20-14(23)21-15/h1-9H,(H2,20,21,22,23)
InChIKey
MHQZOYSHPMLLDI-UHFFFAOYSA-N
Compound name
5-phenyl-5-[3-(trifluoromethyl)phenyl]imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

320.07727 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.084546 170.1
[M+Na]+ 343.066488 179.1
[M-H]- 319.069994 171.3
[M+NH4]+ 338.111093 183.7
[M+K]+ 359.040428 171.8
[M+H-H2O]+ 303.074530 159.5
[M+HCOO]- 365.075471 183.4
[M+CH3COO]- 379.091121 198.2
[M+Na-2H]- 341.051936 172.1
[M]+ 320.07672142 161.8
[M]- 320.07781858 161.8
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

No patent data available for this compound.