CID 81215

1,4-phenylene diacrylate

Structural Information

Molecular Formula
C12H10O4
SMILES
C=CC(=O)OC1=CC=C(C=C1)OC(=O)C=C
InChI
InChI=1S/C12H10O4/c1-3-11(13)15-9-5-7-10(8-6-9)16-12(14)4-2/h3-8H,1-2H2
InChIKey
JMMVHMOAIMOMOF-UHFFFAOYSA-N
Compound name
(4-prop-2-enoyloxyphenyl) prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

2520
Patents

218.0579 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.06518 144.5
[M+Na]+ 241.04712 152.2
[M-H]- 217.05062 148.2
[M+NH4]+ 236.09172 162.8
[M+K]+ 257.02106 150.3
[M+H-H2O]+ 201.05516 138.4
[M+HCOO]- 263.05610 167.8
[M+CH3COO]- 277.07175 186.5
[M+Na-2H]- 239.03257 148.1
[M]+ 218.05735 147.5
[M]- 218.05845 147.5
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