CID 6479

1,3-dibromo-5,5-dimethylhydantoin

Structural Information

Molecular Formula

C₅H₆Br₂N₂O₂

SMILES

CC1(C(=O)N(C(=O)N1Br)Br)C

InChI

InChI=1S/C5H6Br2N2O2/c1-5(2)3(10)8(6)4(11)9(5)7/h1-2H3

InChIKey

VRLDVERQJMEPIF-UHFFFAOYSA-N

Compound name

1,3-dibromo-5,5-dimethylimidazolidine-2,4-dione

Related CIDs

2D Structure

compound 2d structure

7
Annotation Hits: 33
References: 15850
Patents: 283.8796 Da
Monoisotopic Mass: 1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	284.88688	129.2
[M+Na]+	306.86882	143.0
[M-H]-	282.87232	135.0
[M+NH4]+	301.91342	150.4
[M+K]+	322.84276	128.5
[M+H-H2O]+	266.87686	138.4
[M+HCOO]-	328.87780	144.3
[M+CH3COO]-	342.89345	200.4
[M+Na-2H]-	304.85427	135.8
[M]+	283.87905	163.9
[M]-	283.88015	163.9

Literature stripe

literature stripe

Patent stripe

patents stripe