CID 19068806

Palmitamidopropyl diethylamine

Structural Information

Molecular Formula

C₂₃H₄₈N₂O

SMILES

CCCCCCCCCCCCCCCC(=O)NCCCN(CC)CC

InChI

InChI=1S/C23H48N2O/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-20-23(26)24-21-19-22-25(5-2)6-3/h4-22H2,1-3H3,(H,24,26)

InChIKey

DYAVLIWAWOZKBI-UHFFFAOYSA-N

Compound name

N-[3-(diethylamino)propyl]hexadecanamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 2895
Patents: 368.37668 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]+	369.38396	206.4
[M+Na]+	391.36590	205.0
[M-H]-	367.36940	204.8
[M+NH4]+	386.41050	218.9
[M+K]+	407.33984	202.0
[M+H-H2O]+	351.37394	197.6
[M+HCOO]-	413.37488	226.4
[M+CH3COO]-	427.39053	232.6
[M+Na-2H]-	389.35135	202.8
[M]+	368.37613	213.7
[M]-	368.37723	213.7

Literature stripe

literature stripe

Patent stripe

patents stripe