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

478
Patents

172.03717 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.044446 131.6
[M+Na]+ 195.026388 139.1
[M-H]- 171.029894 136.4
[M+NH4]+ 190.070993 150.8
[M+K]+ 211.000328 141.2
[M+H-H2O]+ 155.034430 127.0
[M+HCOO]- 217.035371 153.4
[M+CH3COO]- 231.051021 175.3
[M+Na-2H]- 193.011836 137.0
[M]+ 172.03662142 134.6
[M]- 172.03771858 134.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe