CID 13847

1-ethoxy-2-(2-methoxyethoxy)ethane

Structural Information

Molecular Formula

C₇H₁₆O₃

SMILES

CCOCCOCCOC

InChI

InChI=1S/C7H16O3/c1-3-9-6-7-10-5-4-8-2/h3-7H2,1-2H3

InChIKey

CNJRPYFBORAQAU-UHFFFAOYSA-N

Compound name

1-(2-ethoxyethoxy)-2-methoxyethane

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 1
References: 27195
Patents: 148.10994 Da
Monoisotopic Mass: 0.0
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]+	149.117216	132.1
[M+Na]+	171.099158	138.9
[M-H]-	147.102664	132.2
[M+NH4]+	166.143763	153.7
[M+K]+	187.073098	139.9
[M+H-H2O]+	131.107200	127.2
[M+HCOO]-	193.108141	156.4
[M+CH3COO]-	207.123791	176.2
[M+Na-2H]-	169.084606	138.8
[M]+	148.10939142	138.2
[M]-	148.11048858	138.2

Literature stripe

literature stripe

Patent stripe

patents stripe