CID 123708412

5-hydroxyoxolane-2,3-dione

Structural Information

Molecular Formula

C₄H₄O₄

SMILES

C1C(OC(=O)C1=O)O

InChI

InChI=1S/C4H4O4/c5-2-1-3(6)8-4(2)7/h3,6H,1H2

InChIKey

GHMAEIIKOBMFLV-UHFFFAOYSA-N

Compound name

5-hydroxyoxolane-2,3-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 116.010956 Da
Monoisotopic Mass: -0.8
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]+	117.01823	118.1
[M+Na]+	139.00017	127.9
[M+NH4]+	134.04478	125.4
[M+K]+	154.97411	126.7
[M-H]-	115.00368	118.7
[M+Na-2H]-	136.98562	120.8
[M]+	116.01041	119.2
[M]-	116.01150	119.2

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.