CID 3023013

Hexadecanamide, n-[2-[[2-[[2-[(2-aminoethyl)amino]ethyl]amino]ethyl]amino]ethyl]-

Structural Information

Molecular Formula
C24H53N5O
SMILES
CCCCCCCCCCCCCCCC(=O)NCCNCCNCCNCCN
InChI
InChI=1S/C24H53N5O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-24(30)29-23-22-28-21-20-27-19-18-26-17-16-25/h26-28H,2-23,25H2,1H3,(H,29,30)
InChIKey
PEOXEUKZSKKSAI-UHFFFAOYSA-N
Compound name
N-[2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]ethyl]hexadecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

427.42502 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 428.43230 210.9
[M+Na]+ 450.41424 206.3
[M-H]- 426.41774 207.1
[M+NH4]+ 445.45884 245.6
[M+K]+ 466.38818 202.2
[M+H-H2O]+ 410.42228 200.5
[M+HCOO]- 472.42322 253.5
[M+CH3COO]- 486.43887 246.9
[M+Na-2H]- 448.39969 208.5
[M]+ 427.42447 213.8
[M]- 427.42557 213.8
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.