CID 98381

67196-32-1

Structural Information

Molecular Formula

C₁₀H₁₄N₂O₃

SMILES

CC1CCCCC12C(=O)NC(=O)NC2=O

InChI

InChI=1S/C10H14N2O3/c1-6-4-2-3-5-10(6)7(13)11-9(15)12-8(10)14/h6H,2-5H2,1H3,(H2,11,12,13,14,15)

InChIKey

MOJQTXMYIYJFBE-UHFFFAOYSA-N

Compound name

11-methyl-2,4-diazaspiro[5.5]undecane-1,3,5-trione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 0
Patents: 210.10045 Da
Monoisotopic Mass: 1.2
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]+	211.107726	147.4
[M+Na]+	233.089668	153.9
[M-H]-	209.093174	147.2
[M+NH4]+	228.134273	164.3
[M+K]+	249.063608	150.2
[M+H-H2O]+	193.097710	140.9
[M+HCOO]-	255.098651	159.9
[M+CH3COO]-	269.114301	179.8
[M+Na-2H]-	231.075116	150.3
[M]+	210.09990142	138.4
[M]-	210.10099858	138.4

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.