CID 796166

1-cycloheptylpiperazine

Structural Information

Molecular Formula

C₁₁H₂₂N₂

SMILES

C1CCCC(CC1)N2CCNCC2

InChI

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

InChIKey

CHSINHUYLALJPT-UHFFFAOYSA-N

Compound name

1-cycloheptylpiperazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 187
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	145.7
[M+Na]+	205.16752	153.6
[M+NH4]+	200.21212	153.4
[M+K]+	221.14146	148.5
[M-H]-	181.17102	148.0
[M+Na-2H]-	203.15297	150.8
[M]+	182.17775	147.2
[M]-	182.17885	147.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe