CID 543758

1,2-epoxy-9-decene

Structural Information

Molecular Formula

C₁₀H₁₈O

SMILES

C=CCCCCCCC1CO1

InChI

InChI=1S/C10H18O/c1-2-3-4-5-6-7-8-10-9-11-10/h2,10H,1,3-9H2

InChIKey

FCZHJHKCOZGQJZ-UHFFFAOYSA-N

Compound name

2-oct-7-enyloxirane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 1
References: 2657
Patents: 154.13577 Da
Monoisotopic Mass: 3.4
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]+	155.143046	136.6
[M+Na]+	177.124988	144.6
[M-H]-	153.128494	141.5
[M+NH4]+	172.169593	151.9
[M+K]+	193.098928	143.3
[M+H-H2O]+	137.133030	130.2
[M+HCOO]-	199.133971	159.0
[M+CH3COO]-	213.149621	182.2
[M+Na-2H]-	175.110436	143.4
[M]+	154.13522142	141.9
[M]-	154.13631858	141.9

Literature stripe

literature stripe

Patent stripe

patents stripe