CID 45496510

5-(3-bromophenyl)imidazolidine-2,4-dione

Structural Information

Molecular Formula
C9H7BrN2O2
SMILES
C1=CC(=CC(=C1)Br)C2C(=O)NC(=O)N2
InChI
InChI=1S/C9H7BrN2O2/c10-6-3-1-2-5(4-6)7-8(13)12-9(14)11-7/h1-4,7H,(H2,11,12,13,14)
InChIKey
CGHQCQUIFVSVMG-UHFFFAOYSA-N
Compound name
5-(3-bromophenyl)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

253.96909 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.976366 146.5
[M+Na]+ 276.958308 158.4
[M-H]- 252.961814 151.1
[M+NH4]+ 272.002913 165.1
[M+K]+ 292.932248 145.8
[M+H-H2O]+ 236.966350 146.0
[M+HCOO]- 298.967291 163.5
[M+CH3COO]- 312.982941 184.2
[M+Na-2H]- 274.943756 150.7
[M]+ 253.96854142 160.7
[M]- 253.96963858 160.7
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