CID 9835868

Palmitoleoyl ethanolamide

Structural Information

Molecular Formula
C18H35NO2
SMILES
CCCCCC/C=C\CCCCCCCC(=O)NCCO
InChI
InChI=1S/C18H35NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)19-16-17-20/h7-8,20H,2-6,9-17H2,1H3,(H,19,21)/b8-7-
InChIKey
WFRLANWAASSSFV-FPLPWBNLSA-N
Compound name
(Z)-N-(2-hydroxyethyl)hexadec-9-enamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

35
References

796
Patents

297.26678 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.27406 180.4
[M+Na]+ 320.25600 186.5
[M+NH4]+ 315.30060 185.1
[M+K]+ 336.22994 179.0
[M-H]- 296.25950 178.4
[M+Na-2H]- 318.24145 179.9
[M]+ 297.26623 180.2
[M]- 297.26733 180.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe