CID 94111

(ethoxymethoxy)cyclododecane

Structural Information

Molecular Formula

C₁₅H₃₀O₂

SMILES

CCOCOC1CCCCCCCCCCC1

InChI

InChI=1S/C15H30O2/c1-2-16-14-17-15-12-10-8-6-4-3-5-7-9-11-13-15/h15H,2-14H2,1H3

InChIKey

VQNUNMBDOKEZHS-UHFFFAOYSA-N

Compound name

ethoxymethoxycyclododecane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 5184
Patents: 242.22458 Da
Monoisotopic Mass: 5.5
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]+	243.23186	160.2
[M+Na]+	265.21380	168.6
[M+NH4]+	260.25840	167.6
[M+K]+	281.18774	161.3
[M-H]-	241.21730	162.7
[M+Na-2H]-	263.19925	164.6
[M]+	242.22403	161.6
[M]-	242.22513	161.6

Literature stripe

literature stripe

Patent stripe

patents stripe