CID 2735885

1-(cyclohexylmethyl)piperazine

Structural Information

Molecular Formula

C₁₁H₂₂N₂

SMILES

C1CCC(CC1)CN2CCNCC2

InChI

InChI=1S/C11H22N2/c1-2-4-11(5-3-1)10-13-8-6-12-7-9-13/h11-12H,1-10H2

InChIKey

LRPGNFROBDUREU-UHFFFAOYSA-N

Compound name

1-(cyclohexylmethyl)piperazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 395
Patents: 182.1783 Da
Monoisotopic Mass: 2.0
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]+	183.18558	147.2
[M+Na]+	205.16752	157.2
[M+NH4]+	200.21212	155.9
[M+K]+	221.14146	150.0
[M-H]-	181.17102	150.0
[M+Na-2H]-	203.15297	152.6
[M]+	182.17775	149.1
[M]-	182.17885	149.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe