CID 202159

N-(1-cyclohexylethyl)cyclopropanamine

Structural Information

Molecular Formula

C₁₁H₂₁N

SMILES

CC(C1CCCCC1)NC2CC2

InChI

InChI=1S/C11H21N/c1-9(12-11-7-8-11)10-5-3-2-4-6-10/h9-12H,2-8H2,1H3

InChIKey

ZBZBLHBMSYUBHO-UHFFFAOYSA-N

Compound name

N-(1-cyclohexylethyl)cyclopropanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 167.1674 Da
Monoisotopic Mass: 3.2
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]+	168.17468	137.0
[M+Na]+	190.15662	141.5
[M-H]-	166.16012	143.3
[M+NH4]+	185.20122	152.1
[M+K]+	206.13056	139.6
[M+H-H2O]+	150.16466	130.2
[M+HCOO]-	212.16560	157.3
[M+CH3COO]-	226.18125	185.9
[M+Na-2H]-	188.14207	141.2
[M]+	167.16685	133.4
[M]-	167.16795	133.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe