CID 13983069

1,5-dimethylpiperidine-2,4-dione

Structural Information

Molecular Formula

C₇H₁₁NO₂

SMILES

CC1CN(C(=O)CC1=O)C

InChI

InChI=1S/C7H11NO2/c1-5-4-8(2)7(10)3-6(5)9/h5H,3-4H2,1-2H3

InChIKey

KTVOSJVOLHNLGX-UHFFFAOYSA-N

Compound name

1,5-dimethylpiperidine-2,4-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 141.07898 Da
Monoisotopic Mass: -0.1
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]+	142.08626	128.8
[M+Na]+	164.06820	140.5
[M+NH4]+	159.11280	136.7
[M+K]+	180.04214	135.1
[M-H]-	140.07170	129.5
[M+Na-2H]-	162.05365	133.1
[M]+	141.07843	130.4
[M]-	141.07953	130.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe