CID 13585

Octadecyl vinyl ether

Structural Information

Molecular Formula

C₂₀H₄₀O

SMILES

CCCCCCCCCCCCCCCCCCOC=C

InChI

InChI=1S/C20H40O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-4-2/h4H,2-3,5-20H2,1H3

InChIKey

QJJDJWUCRAPCOL-UHFFFAOYSA-N

Compound name

1-ethenoxyoctadecane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 3
References: 14677
Patents: 296.30792 Da
Monoisotopic Mass: 9.7
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]+	297.31520	182.2
[M+Na]+	319.29714	190.5
[M+NH4]+	314.34174	188.4
[M+K]+	335.27108	180.6
[M-H]-	295.30064	181.5
[M+Na-2H]-	317.28259	183.1
[M]+	296.30737	183.0
[M]-	296.30847	183.0

Literature stripe

literature stripe

Patent stripe

patents stripe