CID 18353926

7528-90-7

Structural Information

Molecular Formula

C₇H₈O₅

SMILES

C=CC(=O)OCC1COC(=O)O1

InChI

InChI=1S/C7H8O5/c1-2-6(8)10-3-5-4-11-7(9)12-5/h2,5H,1,3-4H2

InChIKey

NAQYVERIASFLDB-UHFFFAOYSA-N

Compound name

(2-oxo-1,3-dioxolan-4-yl)methyl prop-2-enoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 488
Patents: 172.03717 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]+	173.04445	133.7
[M+Na]+	195.02639	142.7
[M+NH4]+	190.07099	139.8
[M+K]+	211.00033	141.8
[M-H]-	171.02989	135.0
[M+Na-2H]-	193.01184	135.1
[M]+	172.03662	134.9
[M]-	172.03772	134.9

Literature stripe

literature stripe

Patent stripe

patents stripe