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

36
References

1507
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 181.6
[M+Na]+ 320.25600 183.0
[M-H]- 296.25950 178.3
[M+NH4]+ 315.30060 196.0
[M+K]+ 336.22994 178.8
[M+H-H2O]+ 280.26404 174.6
[M+HCOO]- 342.26498 200.8
[M+CH3COO]- 356.28063 207.2
[M+Na-2H]- 318.24145 180.7
[M]+ 297.26623 185.3
[M]- 297.26733 185.3
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

No patent data available for this compound.