CID 2735038

4-vinyl-1,3-dioxolan-2-one

Structural Information

Molecular Formula

C₅H₆O₃

SMILES

C=CC1COC(=O)O1

InChI

InChI=1S/C5H6O3/c1-2-4-3-7-5(6)8-4/h2,4H,1,3H2

InChIKey

BJWMSGRKJIOCNR-UHFFFAOYSA-N

Compound name

4-ethenyl-1,3-dioxolan-2-one

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 27890
Patents: 114.03169 Da
Monoisotopic Mass: 1.0
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]+	115.03897	119.2
[M+Na]+	137.02091	129.9
[M+NH4]+	132.06551	127.2
[M+K]+	152.99485	127.7
[M-H]-	113.02441	122.1
[M+Na-2H]-	135.00636	122.5
[M]+	114.03114	121.3
[M]-	114.03224	121.3

Literature stripe

literature stripe

Patent stripe

patents stripe