CID 20509516

Stearamide dipa

Structural Information

Molecular Formula

C₂₄H₄₉NO₃

SMILES

CCCCCCCCCCCCCCCCCC(=O)N(CC(C)O)CC(C)O

InChI

InChI=1S/C24H49NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24(28)25(20-22(2)26)21-23(3)27/h22-23,26-27H,4-21H2,1-3H3

InChIKey

ZPIGRJPZEOLQFL-UHFFFAOYSA-N

Compound name

N,N-bis(2-hydroxypropyl)octadecanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 34
Patents: 399.37125 Da
Monoisotopic Mass: 7.6
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]+	400.378526	214.6
[M+Na]+	422.360468	212.4
[M-H]-	398.363974	210.2
[M+NH4]+	417.405073	221.3
[M+K]+	438.334408	209.5
[M+H-H2O]+	382.368510	206.5
[M+HCOO]-	444.369451	221.2
[M+CH3COO]-	458.385101	230.7
[M+Na-2H]-	420.345916	206.8
[M]+	399.37070142	220.8
[M]-	399.37179858	220.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe