CID 21918653

4-(4-nitrophenoxy)piperidine

Structural Information

Molecular Formula

C₁₁H₁₄N₂O₃

SMILES

C1CNCCC1OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H14N2O3/c14-13(15)9-1-3-10(4-2-9)16-11-5-7-12-8-6-11/h1-4,11-12H,5-8H2

InChIKey

JAHDECSRUJTQCB-UHFFFAOYSA-N

Compound name

4-(4-nitrophenoxy)piperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 156
Patents: 222.10045 Da
Monoisotopic Mass: 1.8
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]+	223.10773	147.0
[M+Na]+	245.08967	159.4
[M+NH4]+	240.13427	155.0
[M+K]+	261.06361	155.8
[M-H]-	221.09317	151.3
[M+Na-2H]-	243.07512	153.9
[M]+	222.09990	149.7
[M]-	222.10100	149.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe