CID 20567

2-(methoxymethoxy)ethanol

Structural Information

Molecular Formula

C₄H₁₀O₃

SMILES

COCOCCO

InChI

InChI=1S/C4H10O3/c1-6-4-7-3-2-5/h5H,2-4H2,1H3

InChIKey

INFFATMFXZFLAO-UHFFFAOYSA-N

Compound name

2-(methoxymethoxy)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4127
Patents: 106.062996 Da
Monoisotopic Mass: -0.7
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]+	107.070272	119.0
[M+Na]+	129.052214	126.6
[M-H]-	105.055720	118.1
[M+NH4]+	124.096819	141.4
[M+K]+	145.026154	127.4
[M+H-H2O]+	89.060256	114.8
[M+HCOO]-	151.061197	142.7
[M+CH3COO]-	165.076847	164.4
[M+Na-2H]-	127.037662	126.7
[M]+	106.06244742	122.0
[M]-	106.06354458	122.0

Literature stripe

literature stripe

Patent stripe

patents stripe