CID 3039600

50849-39-3

Structural Information

Molecular Formula

C₁₀H₁₇NO₂

SMILES

CC(C)CC1(CC(=O)NC(=O)C1)C

InChI

InChI=1S/C10H17NO2/c1-7(2)4-10(3)5-8(12)11-9(13)6-10/h7H,4-6H2,1-3H3,(H,11,12,13)

InChIKey

CXEDDPDGICQBFN-UHFFFAOYSA-N

Compound name

4-methyl-4-(2-methylpropyl)piperidine-2,6-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 183.12593 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]+	184.133206	140.6
[M+Na]+	206.115148	147.2
[M-H]-	182.118654	141.2
[M+NH4]+	201.159753	160.7
[M+K]+	222.089088	145.4
[M+H-H2O]+	166.123190	135.7
[M+HCOO]-	228.124131	157.5
[M+CH3COO]-	242.139781	180.5
[M+Na-2H]-	204.100596	143.6
[M]+	183.12538142	137.2
[M]-	183.12647858	137.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.