CID 79098

2,5-dimethoxytetrahydrofuran

Structural Information

Molecular Formula

C₆H₁₂O₃

SMILES

COC1CCC(O1)OC

InChI

InChI=1S/C6H12O3/c1-7-5-3-4-6(8-2)9-5/h5-6H,3-4H2,1-2H3

InChIKey

GFISDBXSWQMOND-UHFFFAOYSA-N

Compound name

2,5-dimethoxyoxolane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 5
References: 7579
Patents: 132.07864 Da
Monoisotopic Mass: 0.6
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]+	133.08592	124.6
[M+Na]+	155.06786	132.0
[M-H]-	131.07136	128.7
[M+NH4]+	150.11246	147.1
[M+K]+	171.04180	133.9
[M+H-H2O]+	115.07590	120.0
[M+HCOO]-	177.07684	147.7
[M+CH3COO]-	191.09249	170.2
[M+Na-2H]-	153.05331	130.6
[M]+	132.07809	126.5
[M]-	132.07919	126.5

Literature stripe

literature stripe

Patent stripe

patents stripe