CID 3350716

2h-pyran, tetrahydro-4,4-dimethoxy-

Structural Information

Molecular Formula

C₇H₁₄O₃

SMILES

COC1(CCOCC1)OC

InChI

InChI=1S/C7H14O3/c1-8-7(9-2)3-5-10-6-4-7/h3-6H2,1-2H3

InChIKey

FBZWVZPRCICVPX-UHFFFAOYSA-N

Compound name

4,4-dimethoxyoxane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 182
Patents: 146.0943 Da
Monoisotopic Mass: 0.3
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	128.8
[M+Na]+	169.08352	134.8
[M-H]-	145.08702	132.7
[M+NH4]+	164.12812	150.7
[M+K]+	185.05746	137.0
[M+H-H2O]+	129.09156	124.1
[M+HCOO]-	191.09250	149.5
[M+CH3COO]-	205.10815	171.9
[M+Na-2H]-	167.06897	137.4
[M]+	146.09375	129.0
[M]-	146.09485	129.0

Literature stripe

literature stripe

Patent stripe

patents stripe