CID 44630610

5-ethyl-1-methylpiperazin-2-one

Structural Information

Molecular Formula

C₇H₁₄N₂O

SMILES

CCC1CN(C(=O)CN1)C

InChI

InChI=1S/C7H14N2O/c1-3-6-5-9(2)7(10)4-8-6/h6,8H,3-5H2,1-2H3

InChIKey

QLFQFGAIOKXHLN-UHFFFAOYSA-N

Compound name

5-ethyl-1-methylpiperazin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 142.11061 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]+	143.11789	132.1
[M+Na]+	165.09983	143.0
[M+NH4]+	160.14443	139.6
[M+K]+	181.07377	137.5
[M-H]-	141.10333	132.1
[M+Na-2H]-	163.08528	136.0
[M]+	142.11006	133.3
[M]-	142.11116	133.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.