CID 88195

2,5,8,11-tetraoxatetradec-13-ene

Structural Information

Molecular Formula

C₁₀H₂₀O₄

SMILES

COCCOCCOCCOCC=C

InChI

InChI=1S/C10H20O4/c1-3-4-12-7-8-14-10-9-13-6-5-11-2/h3H,1,4-10H2,2H3

InChIKey

QOQTULDKYFWBLQ-UHFFFAOYSA-N

Compound name

3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]prop-1-ene

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 241
Patents: 204.13615 Da
Monoisotopic Mass: 0.3
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]+	205.14343	146.9
[M+Na]+	227.12537	155.8
[M+NH4]+	222.16997	153.1
[M+K]+	243.09931	150.0
[M-H]-	203.12887	145.1
[M+Na-2H]-	225.11082	149.1
[M]+	204.13560	147.3
[M]-	204.13670	147.3

Literature stripe

literature stripe

Patent stripe

patents stripe