CID 2341162

5,5-bis(4-methylphenyl)hydantoin

Structural Information

Molecular Formula
C17H16N2O2
SMILES
CC1=CC=C(C=C1)C2(C(=O)NC(=O)N2)C3=CC=C(C=C3)C
InChI
InChI=1S/C17H16N2O2/c1-11-3-7-13(8-4-11)17(15(20)18-16(21)19-17)14-9-5-12(2)6-10-14/h3-10H,1-2H3,(H2,18,19,20,21)
InChIKey
DAERXVGJQHMIKV-UHFFFAOYSA-N
Compound name
5,5-bis(4-methylphenyl)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

28
Patents

280.1212 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.12848 165.1
[M+Na]+ 303.11042 174.0
[M-H]- 279.11392 170.4
[M+NH4]+ 298.15502 180.8
[M+K]+ 319.08436 167.4
[M+H-H2O]+ 263.11846 156.9
[M+HCOO]- 325.11940 183.0
[M+CH3COO]- 339.13505 176.1
[M+Na-2H]- 301.09587 166.7
[M]+ 280.12065 161.4
[M]- 280.12175 161.4
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