CID 5073938

1-vinyl-13-oxabicyclo[10.1.0]tridecane

Structural Information

Molecular Formula

C₁₄H₂₄O

SMILES

C=CC12CCCCCCCCCCC1O2

InChI

InChI=1S/C14H24O/c1-2-14-12-10-8-6-4-3-5-7-9-11-13(14)15-14/h2,13H,1,3-12H2

InChIKey

GKPLONGGOJXWJN-UHFFFAOYSA-N

Compound name

1-ethenyl-13-oxabicyclo[10.1.0]tridecane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 16
Patents: 208.18271 Da
Monoisotopic Mass: 4.9
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]+	209.18999	147.4
[M+Na]+	231.17193	159.0
[M+NH4]+	226.21653	157.8
[M+K]+	247.14587	151.6
[M-H]-	207.17543	158.4
[M+Na-2H]-	229.15738	155.7
[M]+	208.18216	153.2
[M]-	208.18326	153.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe