CID 3060768

3-ethylglutarimide

Structural Information

Molecular Formula

C₇H₁₁NO₂

SMILES

CCC1CC(=O)NC(=O)C1

InChI

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

InChIKey

JOXZQJXTAKJQTF-UHFFFAOYSA-N

Compound name

4-ethylpiperidine-2,6-dione

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 19
Patents: 141.07898 Da
Monoisotopic Mass: 0.3
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]+	142.086256	128.4
[M+Na]+	164.068198	135.6
[M-H]-	140.071704	129.1
[M+NH4]+	159.112803	148.2
[M+K]+	180.042138	133.7
[M+H-H2O]+	124.076240	122.9
[M+HCOO]-	186.077181	147.3
[M+CH3COO]-	200.092831	170.9
[M+Na-2H]-	162.053646	132.9
[M]+	141.07843142	124.2
[M]-	141.07952858	124.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe