CID 119025996

Peg-3 oleamide

Structural Information

Molecular Formula
C24H47NO4
SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)NCCOCCOCCO
InChI
InChI=1S/C24H47NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(27)25-18-20-28-22-23-29-21-19-26/h9-10,26H,2-8,11-23H2,1H3,(H,25,27)/b10-9-
InChIKey
MOUZJOLAMBUMFE-KTKRTIGZSA-N
Compound name
(Z)-N-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]octadec-9-enamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

422
Patents

413.3505 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 414.35778 211.4
[M+Na]+ 436.33972 215.2
[M+NH4]+ 431.38432 221.3
[M+K]+ 452.31366 222.3
[M-H]- 412.34322 210.5
[M+Na-2H]- 434.32517 208.5
[M]+ 413.34995 210.3
[M]- 413.35105 210.3
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

patents stripe