CID 53424506

52049-17-9

Structural Information

Molecular Formula
C14H14O4
SMILES
C=CC(=O)OCCOC(=O)C=CC1=CC=CC=C1
InChI
InChI=1S/C14H14O4/c1-2-13(15)17-10-11-18-14(16)9-8-12-6-4-3-5-7-12/h2-9H,1,10-11H2
InChIKey
WWFHNTLFRMYXKQ-UHFFFAOYSA-N
Compound name
2-prop-2-enoyloxyethyl 3-phenylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

127
Patents

246.0892 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.096476 155.3
[M+Na]+ 269.078418 161.3
[M-H]- 245.081924 158.3
[M+NH4]+ 264.123023 172.2
[M+K]+ 285.052358 158.8
[M+H-H2O]+ 229.086460 148.5
[M+HCOO]- 291.087401 178.0
[M+CH3COO]- 305.103051 190.7
[M+Na-2H]- 267.063866 158.4
[M]+ 246.08865142 158.5
[M]- 246.08974858 158.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.