CID 39850

Dicyclopentadienyl acrylate

Structural Information

Molecular Formula
C13H14O2
SMILES
C=CC(=O)OC1C=CC2C1C3CC2C=C3
InChI
InChI=1S/C13H14O2/c1-2-12(14)15-11-6-5-10-8-3-4-9(7-8)13(10)11/h2-6,8-11,13H,1,7H2
InChIKey
VEVJYJYFAXTUGJ-UHFFFAOYSA-N
Compound name
3-tricyclo[5.2.1.02,6]deca-4,8-dienyl prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

11
Patents

202.09938 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.10666 145.9
[M+Na]+ 225.08860 154.4
[M+NH4]+ 220.13320 155.3
[M+K]+ 241.06254 153.8
[M-H]- 201.09210 146.0
[M+Na-2H]- 223.07405 146.2
[M]+ 202.09883 146.8
[M]- 202.09993 146.8
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

patents stripe