CID 62773515

1425972-13-9

Structural Information

Molecular Formula

C₆H₁₀O₂

SMILES

C1COCC1C2CO2

InChI

InChI=1S/C6H10O2/c1-2-7-3-5(1)6-4-8-6/h5-6H,1-4H2

InChIKey

HEMSSMIBAFJYAM-UHFFFAOYSA-N

Compound name

3-(oxiran-2-yl)oxolane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 114.06808 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]+	115.07536	119.4
[M+Na]+	137.05730	128.1
[M-H]-	113.06080	128.1
[M+NH4]+	132.10190	136.2
[M+K]+	153.03124	129.8
[M+H-H2O]+	97.065340	113.9
[M+HCOO]-	159.06628	141.3
[M+CH3COO]-	173.08193	169.8
[M+Na-2H]-	135.04275	127.5
[M]+	114.06753	121.5
[M]-	114.06863	121.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe