CID 3409233

4-(4-methoxyphenoxy)piperidine

Structural Information

Molecular Formula

C₁₂H₁₇NO₂

SMILES

COC1=CC=C(C=C1)OC2CCNCC2

InChI

InChI=1S/C12H17NO2/c1-14-10-2-4-11(5-3-10)15-12-6-8-13-9-7-12/h2-5,12-13H,6-9H2,1H3

InChIKey

HRMYEAQYLDCUGG-UHFFFAOYSA-N

Compound name

4-(4-methoxyphenoxy)piperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 124
Patents: 207.12593 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]+	208.133206	146.6
[M+Na]+	230.115148	151.3
[M-H]-	206.118654	149.6
[M+NH4]+	225.159753	163.0
[M+K]+	246.089088	148.6
[M+H-H2O]+	190.123190	138.7
[M+HCOO]-	252.124131	164.9
[M+CH3COO]-	266.139781	182.2
[M+Na-2H]-	228.100596	151.6
[M]+	207.12538142	142.5
[M]-	207.12647858	142.5

Literature stripe

literature stripe

Patent stripe

patents stripe