CID 28694222

859521-69-0

Structural Information

Molecular Formula

C₁₁H₂₁NO

SMILES

C1CCC(CC1)NC2CCOCC2

InChI

InChI=1S/C11H21NO/c1-2-4-10(5-3-1)12-11-6-8-13-9-7-11/h10-12H,1-9H2

InChIKey

WGSUEWAHEXYQGS-UHFFFAOYSA-N

Compound name

N-cyclohexyloxan-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 38
Patents: 183.16231 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]+	184.169586	143.0
[M+Na]+	206.151528	143.8
[M-H]-	182.155034	148.1
[M+NH4]+	201.196133	160.3
[M+K]+	222.125468	143.3
[M+H-H2O]+	166.159570	135.7
[M+HCOO]-	228.160511	160.0
[M+CH3COO]-	242.176161	182.0
[M+Na-2H]-	204.136976	147.8
[M]+	183.16176142	133.7
[M]-	183.16285858	133.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe