CID 109699

Einecs 269-176-6

Structural Information

Molecular Formula
C22H46N2O2
SMILES
CC(C)CCCCCCCCCCCCCCC(=O)NCCNCCO
InChI
InChI=1S/C22H46N2O2/c1-21(2)15-13-11-9-7-5-3-4-6-8-10-12-14-16-22(26)24-18-17-23-19-20-25/h21,23,25H,3-20H2,1-2H3,(H,24,26)
InChIKey
ZSNDZDQBWDNNSH-UHFFFAOYSA-N
Compound name
N-[2-(2-hydroxyethylamino)ethyl]-16-methylheptadecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

370.35593 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.36321 202.2
[M+Na]+ 393.34515 205.7
[M+NH4]+ 388.38975 205.7
[M+K]+ 409.31909 198.7
[M-H]- 369.34865 200.3
[M+Na-2H]- 391.33060 200.1
[M]+ 370.35538 201.5
[M]- 370.35648 201.5
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.