CID 351024

Diethylene glycol diglycidyl ether

Structural Information

Molecular Formula

C₁₀H₁₈O₅

SMILES

C1C(O1)COCCOCCOCC2CO2

InChI

InChI=1S/C10H18O5/c1(3-12-5-9-7-14-9)11-2-4-13-6-10-8-15-10/h9-10H,1-8H2

InChIKey

SEFYJVFBMNOLBK-UHFFFAOYSA-N

Compound name

2-[2-[2-(oxiran-2-ylmethoxy)ethoxy]ethoxymethyl]oxirane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 15894
Patents: 218.11542 Da
Monoisotopic Mass: -0.8
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]+	219.122696	158.8
[M+Na]+	241.104638	165.4
[M-H]-	217.108144	166.8
[M+NH4]+	236.149243	164.0
[M+K]+	257.078578	167.1
[M+H-H2O]+	201.112680	151.4
[M+HCOO]-	263.113621	177.4
[M+CH3COO]-	277.129271	198.0
[M+Na-2H]-	239.090086	163.9
[M]+	218.11487142	169.9
[M]-	218.11596858	169.9

Literature stripe

literature stripe

Patent stripe

patents stripe