CID 6436522

Oleylamidoethylenoxyethanol

Structural Information

Molecular Formula

C₂₂H₄₃NO₃

SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)NCCOCCO

InChI

InChI=1S/C22H43NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(25)23-18-20-26-21-19-24/h9-10,24H,2-8,11-21H2,1H3,(H,23,25)/b10-9-

InChIKey

ULHGTPIJYDGNHZ-KTKRTIGZSA-N

Compound name

(Z)-N-[2-(2-hydroxyethoxy)ethyl]octadec-9-enamide

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 1
References: 17
Patents: 369.32428 Da
Monoisotopic Mass: 6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	370.33156	201.4
[M+Na]+	392.31350	201.0
[M-H]-	368.31700	197.2
[M+NH4]+	387.35810	212.8
[M+K]+	408.28744	196.4
[M+H-H2O]+	352.32154	193.4
[M+HCOO]-	414.32248	219.6
[M+CH3COO]-	428.33813	221.1
[M+Na-2H]-	390.29895	198.6
[M]+	369.32373	208.1
[M]-	369.32483	208.1

Literature stripe

literature stripe

Patent stripe

patents stripe