CID 67511

3,4-epoxytetrahydrofuran

Structural Information

Molecular Formula

C₄H₆O₂

SMILES

C1C2C(O2)CO1

InChI

InChI=1S/C4H6O2/c1-3-4(6-3)2-5-1/h3-4H,1-2H2

InChIKey

AIUTZIYTEUMXGG-UHFFFAOYSA-N

Compound name

3,6-dioxabicyclo[3.1.0]hexane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 1191
Patents: 86.03678 Da
Monoisotopic Mass: -0.4
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]+	87.044056	114.4
[M+Na]+	109.02600	127.0
[M+NH4]+	104.07060	124.7
[M+K]+	124.99994	125.4
[M-H]-	85.029504	125.1
[M+Na-2H]-	107.01145	120.9
[M]+	86.036231	120.3
[M]-	86.037329	120.3

Literature stripe

literature stripe

Patent stripe

patents stripe