CID 6437597

4-oleoylmorpholine

Structural Information

Molecular Formula

C₂₂H₄₁NO₂

SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)N1CCOCC1

InChI

InChI=1S/C22H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(24)23-18-20-25-21-19-23/h9-10H,2-8,11-21H2,1H3/b10-9-

InChIKey

RZLQCNYCMRDLBA-KTKRTIGZSA-N

Compound name

(Z)-1-morpholin-4-yloctadec-9-en-1-one

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 2
References: 45
Patents: 351.31372 Da
Monoisotopic Mass: 6.8
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]+	352.320996	197.4
[M+Na]+	374.302938	196.6
[M-H]-	350.306444	196.5
[M+NH4]+	369.347543	207.4
[M+K]+	390.276878	193.2
[M+H-H2O]+	334.310980	188.1
[M+HCOO]-	396.311921	210.8
[M+CH3COO]-	410.327571	215.9
[M+Na-2H]-	372.288386	195.2
[M]+	351.31317142	199.5
[M]-	351.31426858	199.5

Literature stripe

literature stripe

Patent stripe

patents stripe