CID 108780

Stearamidopropyl morpholine

Structural Information

Molecular Formula

C₂₅H₅₀N₂O₂

SMILES

CCCCCCCCCCCCCCCCCC(=O)NCCCN1CCOCC1

InChI

InChI=1S/C25H50N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-25(28)26-19-17-20-27-21-23-29-24-22-27/h2-24H2,1H3,(H,26,28)

InChIKey

DIHCYFIQOLPTQW-UHFFFAOYSA-N

Compound name

N-(3-morpholin-4-ylpropyl)octadecanamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 102
Patents: 410.38724 Da
Monoisotopic Mass: 8.0
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]+	411.39452	214.2
[M+Na]+	433.37646	219.6
[M+NH4]+	428.42106	218.4
[M+K]+	449.35040	211.0
[M-H]-	409.37996	215.5
[M+Na-2H]-	431.36191	213.3
[M]+	410.38669	214.8
[M]-	410.38779	214.8

Literature stripe

literature stripe

Patent stripe

patents stripe