CID 15086343

5,6-dihydro-4-methoxy-2h-pyran-2-one

Structural Information

Molecular Formula

C₆H₈O₃

SMILES

COC1=CC(=O)OCC1

InChI

InChI=1S/C6H8O3/c1-8-5-2-3-9-6(7)4-5/h4H,2-3H2,1H3

InChIKey

MEZHTUKDGVTUCD-UHFFFAOYSA-N

Compound name

4-methoxy-2,3-dihydropyran-6-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 128.04735 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]+	129.05463	122.0
[M+Na]+	151.03657	134.2
[M+NH4]+	146.08117	130.6
[M+K]+	167.01051	129.2
[M-H]-	127.04007	124.8
[M+Na-2H]-	149.02202	127.7
[M]+	128.04680	124.4
[M]-	128.04790	124.4

Literature stripe

literature stripe

Patent stripe

patents stripe