CID 83906766

2174002-30-1

Structural Information

Molecular Formula

C₁₁H₂₁NO

SMILES

C1CC(COC1)CC2CCNCC2

InChI

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

InChIKey

TVGXAUXIUSRYEB-UHFFFAOYSA-N

Compound name

4-(oxan-3-ylmethyl)piperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 183.16231 Da
Monoisotopic Mass: 1.5
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	144.7
[M+Na]+	206.151528	145.9
[M-H]-	182.155034	147.0
[M+NH4]+	201.196133	160.2
[M+K]+	222.125468	144.5
[M+H-H2O]+	166.159570	136.9
[M+HCOO]-	228.160511	157.8
[M+CH3COO]-	242.176161	177.2
[M+Na-2H]-	204.136976	148.5
[M]+	183.16176142	134.7
[M]-	183.16285858	134.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.