CID 3022510

Brn 1320705

Structural Information

Molecular Formula

C₁₇H₂₆N₂O₂

SMILES

CCC(=O)N(C1=CC=C(C=C1)O)C(C)CN2CCCCC2

InChI

InChI=1S/C17H26N2O2/c1-3-17(21)19(15-7-9-16(20)10-8-15)14(2)13-18-11-5-4-6-12-18/h7-10,14,20H,3-6,11-13H2,1-2H3

InChIKey

PQNZGAPAODOVEH-UHFFFAOYSA-N

Compound name

N-(4-hydroxyphenyl)-N-(1-piperidin-1-ylpropan-2-yl)propanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 290.19943 Da
Monoisotopic Mass: 2.7
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]+	291.206706	171.7
[M+Na]+	313.188648	173.3
[M-H]-	289.192154	175.4
[M+NH4]+	308.233253	184.8
[M+K]+	329.162588	171.2
[M+H-H2O]+	273.196690	162.7
[M+HCOO]-	335.197631	188.0
[M+CH3COO]-	349.213281	205.9
[M+Na-2H]-	311.174096	171.3
[M]+	290.19888142	167.9
[M]-	290.19997858	167.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.