CID 105307

Hexadecanamide, n-[3-[bis(2-hydroxyethyl)amino]propyl]-

Structural Information

Molecular Formula
C23H48N2O3
SMILES
CCCCCCCCCCCCCCCC(=O)NCCCN(CCO)CCO
InChI
InChI=1S/C23H48N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-23(28)24-17-15-18-25(19-21-26)20-22-27/h26-27H,2-22H2,1H3,(H,24,28)
InChIKey
ODOPLSJHUSYCFN-UHFFFAOYSA-N
Compound name
N-[3-[bis(2-hydroxyethyl)amino]propyl]hexadecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

400.3665 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 401.37378 210.6
[M+Na]+ 423.35572 208.1
[M-H]- 399.35922 206.1
[M+NH4]+ 418.40032 225.1
[M+K]+ 439.32966 204.6
[M+H-H2O]+ 383.36376 201.7
[M+HCOO]- 445.36470 232.0
[M+CH3COO]- 459.38035 231.3
[M+Na-2H]- 421.34117 206.3
[M]+ 400.36595 216.8
[M]- 400.36705 216.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.