CID 44441629

N-(4-hydroxyphenethyl)oleamide

Structural Information

Molecular Formula
C26H43NO2
SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)NCCC1=CC=C(C=C1)O
InChI
InChI=1S/C26H43NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26(29)27-23-22-24-18-20-25(28)21-19-24/h9-10,18-21,28H,2-8,11-17,22-23H2,1H3,(H,27,29)/b10-9-
InChIKey
MWHSBABGQKDUFQ-KTKRTIGZSA-N
Compound name
(Z)-N-[2-(4-hydroxyphenyl)ethyl]octadec-9-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

5
Patents

401.32938 Da
Monoisotopic Mass

8.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 402.33666 209.3
[M+Na]+ 424.31860 209.2
[M-H]- 400.32210 208.4
[M+NH4]+ 419.36320 219.2
[M+K]+ 440.29254 202.6
[M+H-H2O]+ 384.32664 200.2
[M+HCOO]- 446.32758 227.4
[M+CH3COO]- 460.34323 227.6
[M+Na-2H]- 422.30405 206.2
[M]+ 401.32883 213.7
[M]- 401.32993 213.7
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