CID 3157471

1-cyclohexylpiperazin-2-one hydrochloride

Structural Information

Molecular Formula

C₁₀H₁₈N₂O

SMILES

C1CCC(CC1)N2CCNCC2=O

InChI

InChI=1S/C10H18N2O/c13-10-8-11-6-7-12(10)9-4-2-1-3-5-9/h9,11H,1-8H2

InChIKey

OSFLFWJEDYTKEX-UHFFFAOYSA-N

Compound name

1-cyclohexylpiperazin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 67
Patents: 182.1419 Da
Monoisotopic Mass: 0.9
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]+	183.14918	144.6
[M+Na]+	205.13112	154.8
[M+NH4]+	200.17572	152.7
[M+K]+	221.10506	148.4
[M-H]-	181.13462	146.8
[M+Na-2H]-	203.11657	149.5
[M]+	182.14135	146.3
[M]-	182.14245	146.3

Literature stripe

literature stripe

Patent stripe

patents stripe