CID 43823228

2-[(2-naphthyloxy)methyl]piperidine

Structural Information

Molecular Formula

C₁₆H₁₉NO

SMILES

C1CCNC(C1)COC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C16H19NO/c1-2-6-14-11-16(9-8-13(14)5-1)18-12-15-7-3-4-10-17-15/h1-2,5-6,8-9,11,15,17H,3-4,7,10,12H2

InChIKey

PEEWGYRFMHANGE-UHFFFAOYSA-N

Compound name

2-(naphthalen-2-yloxymethyl)piperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 241.14667 Da
Monoisotopic Mass: 3.6
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]+	242.153946	155.5
[M+Na]+	264.135888	159.9
[M-H]-	240.139394	158.9
[M+NH4]+	259.180493	171.3
[M+K]+	280.109828	154.8
[M+H-H2O]+	224.143930	146.8
[M+HCOO]-	286.144871	172.0
[M+CH3COO]-	300.160521	165.6
[M+Na-2H]-	262.121336	161.4
[M]+	241.14612142	150.0
[M]-	241.14721858	150.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.