CID 110717

Glycofurol

Structural Information

Molecular Formula

C₇H₁₄O₃

SMILES

C1CC(OC1)COCCO

InChI

InChI=1S/C7H14O3/c8-3-5-9-6-7-2-1-4-10-7/h7-8H,1-6H2

InChIKey

CTPDSKVQLSDPLC-UHFFFAOYSA-N

Compound name

2-(oxolan-2-ylmethoxy)ethanol

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 42
References: 13641
Patents: 146.0943 Da
Monoisotopic Mass: -0.2
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]+	147.10158	130.7
[M+Na]+	169.08352	136.2
[M-H]-	145.08702	132.8
[M+NH4]+	164.12812	151.6
[M+K]+	185.05746	136.9
[M+H-H2O]+	129.09156	125.7
[M+HCOO]-	191.09250	151.9
[M+CH3COO]-	205.10815	169.4
[M+Na-2H]-	167.06897	136.2
[M]+	146.09375	130.7
[M]-	146.09485	130.7

Literature stripe

literature stripe

Patent stripe

patents stripe