CID 3159681

876717-44-1

Structural Information

Molecular Formula

C₁₁H₂₂N₂

SMILES

C1CCC(CC1)(CN2CCCC2)N

InChI

InChI=1S/C11H22N2/c12-11(6-2-1-3-7-11)10-13-8-4-5-9-13/h1-10,12H2

InChIKey

FFNSNUBYKYSWNB-UHFFFAOYSA-N

Compound name

1-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 12
Patents: 182.1783 Da
Monoisotopic Mass: 1.4
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	146.0
[M+Na]+	205.16752	154.2
[M+NH4]+	200.21212	156.5
[M+K]+	221.14146	147.6
[M-H]-	181.17102	149.5
[M+Na-2H]-	203.15297	152.3
[M]+	182.17775	148.0
[M]-	182.17885	148.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe