CID 19914424

94134-12-0

Structural Information

Molecular Formula

C₁₂H₁₈N₄O₄

SMILES

C1C(=O)NC(=O)N1CCCCCCN2CC(=O)NC2=O

InChI

InChI=1S/C12H18N4O4/c17-9-7-15(11(19)13-9)5-3-1-2-4-6-16-8-10(18)14-12(16)20/h1-8H2,(H,13,17,19)(H,14,18,20)

InChIKey

PVGMGWHNYDUURH-UHFFFAOYSA-N

Compound name

1-[6-(2,4-dioxoimidazolidin-1-yl)hexyl]imidazolidine-2,4-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 282.1328 Da
Monoisotopic Mass: -0.5
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]+	283.140076	166.6
[M+Na]+	305.122018	172.9
[M-H]-	281.125524	165.1
[M+NH4]+	300.166623	178.9
[M+K]+	321.095958	168.8
[M+H-H2O]+	265.130060	158.1
[M+HCOO]-	327.131001	180.4
[M+CH3COO]-	341.146651	193.9
[M+Na-2H]-	303.107466	162.7
[M]+	282.13225142	163.5
[M]-	282.13334858	163.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe