CID 71058

1237-52-1

Structural Information

Molecular Formula

C₂₀H₂₄N₂O

SMILES

CC(=O)N(C1CCN(CC1)CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H24N2O/c1-17(23)22(19-10-6-3-7-11-19)20-12-14-21(15-13-20)16-18-8-4-2-5-9-18/h2-11,20H,12-16H2,1H3

InChIKey

UKGXYSOSRSCGJB-UHFFFAOYSA-N

Compound name

N-(1-benzylpiperidin-4-yl)-N-phenylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 308.18887 Da
Monoisotopic Mass: 3.1
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]+	309.196146	175.2
[M+Na]+	331.178088	177.4
[M-H]-	307.181594	183.1
[M+NH4]+	326.222693	187.6
[M+K]+	347.152028	173.6
[M+H-H2O]+	291.186130	164.4
[M+HCOO]-	353.187071	194.0
[M+CH3COO]-	367.202721	210.3
[M+Na-2H]-	329.163536	177.3
[M]+	308.18832142	170.6
[M]-	308.18941858	170.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe