CID 24851

10043-09-1

Structural Information

Molecular Formula

C₁₀H₁₆O₆

SMILES

C1COC(C(O1)OCC2CO2)OCC3CO3

InChI

InChI=1S/C10H16O6/c1-2-12-10(16-6-8-4-14-8)9(11-1)15-5-7-3-13-7/h7-10H,1-6H2

InChIKey

KGOPPGGOMZHMIR-UHFFFAOYSA-N

Compound name

2,3-bis(oxiran-2-ylmethoxy)-1,4-dioxane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 42
Patents: 232.09468 Da
Monoisotopic Mass: -0.9
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]+	233.10196	158.9
[M+Na]+	255.08390	165.1
[M-H]-	231.08740	170.5
[M+NH4]+	250.12850	161.2
[M+K]+	271.05784	170.1
[M+H-H2O]+	215.09194	151.3
[M+HCOO]-	277.09288	173.2
[M+CH3COO]-	291.10853	199.1
[M+Na-2H]-	253.06935	164.6
[M]+	232.09413	167.2
[M]-	232.09523	167.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe