CID 3870843

64952-07-4

Structural Information

Molecular Formula

C₉H₁₄N₂O₂

SMILES

C1CCC(CC1)C2C(=O)NC(=O)N2

InChI

InChI=1S/C9H14N2O2/c12-8-7(10-9(13)11-8)6-4-2-1-3-5-6/h6-7H,1-5H2,(H2,10,11,12,13)

InChIKey

XMFKECBJDYLFKU-UHFFFAOYSA-N

Compound name

5-cyclohexylimidazolidine-2,4-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 16
Patents: 182.10553 Da
Monoisotopic Mass: 1.4
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]+	183.11281	142.1
[M+Na]+	205.09475	147.1
[M-H]-	181.09825	142.5
[M+NH4]+	200.13935	159.2
[M+K]+	221.06869	143.5
[M+H-H2O]+	165.10279	134.9
[M+HCOO]-	227.10373	156.8
[M+CH3COO]-	241.11938	173.7
[M+Na-2H]-	203.08020	142.7
[M]+	182.10498	132.5
[M]-	182.10608	132.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe