CID 3064457

Brn 6062676

Structural Information

Molecular Formula

C₁₅H₂₃NO₃

SMILES

CCOC1=CC=CC=C1OCC2(CCCNC2)OC

InChI

InChI=1S/C15H23NO3/c1-3-18-13-7-4-5-8-14(13)19-12-15(17-2)9-6-10-16-11-15/h4-5,7-8,16H,3,6,9-12H2,1-2H3

InChIKey

HJHPUWGTDFJGHX-UHFFFAOYSA-N

Compound name

3-[(2-ethoxyphenoxy)methyl]-3-methoxypiperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 265.1678 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]+	266.175076	163.3
[M+Na]+	288.157018	167.6
[M-H]-	264.160524	166.1
[M+NH4]+	283.201623	179.3
[M+K]+	304.130958	165.1
[M+H-H2O]+	248.165060	155.2
[M+HCOO]-	310.166001	180.9
[M+CH3COO]-	324.181651	192.9
[M+Na-2H]-	286.142466	167.8
[M]+	265.16725142	162.1
[M]-	265.16834858	162.1

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.