CID 97775

3-methyl-3-n-butylglutarimide

Structural Information

Molecular Formula

C₁₀H₁₇NO₂

SMILES

CCCCC1(CC(=O)NC(=O)C1)C

InChI

InChI=1S/C10H17NO2/c1-3-4-5-10(2)6-8(12)11-9(13)7-10/h3-7H2,1-2H3,(H,11,12,13)

InChIKey

ODECDNHHLPNMMC-UHFFFAOYSA-N

Compound name

4-butyl-4-methylpiperidine-2,6-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 183.12593 Da
Monoisotopic Mass: 1.8
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]+	184.133206	140.7
[M+Na]+	206.115148	147.6
[M-H]-	182.118654	141.3
[M+NH4]+	201.159753	160.9
[M+K]+	222.089088	145.3
[M+H-H2O]+	166.123190	135.6
[M+HCOO]-	228.124131	158.7
[M+CH3COO]-	242.139781	179.6
[M+Na-2H]-	204.100596	144.9
[M]+	183.12538142	138.0
[M]-	183.12647858	138.0

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.