CID 13001872

Dicyclopentanyl acrylate (stabilized with mehq)

Structural Information

Molecular Formula
C13H18O2
SMILES
C=CC(=O)OC1CC2CC1C3C2CCC3
InChI
InChI=1S/C13H18O2/c1-2-13(14)15-12-7-8-6-11(12)10-5-3-4-9(8)10/h2,8-12H,1,3-7H2
InChIKey
BDYXPMNDZDGGTI-UHFFFAOYSA-N
Compound name
8-tricyclo[5.2.1.02,6]decanyl prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

204
Patents

206.13068 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.13796 153.3
[M+Na]+ 229.11990 159.7
[M-H]- 205.12340 156.8
[M+NH4]+ 224.16450 180.0
[M+K]+ 245.09384 156.8
[M+H-H2O]+ 189.12794 149.9
[M+HCOO]- 251.12888 172.0
[M+CH3COO]- 265.14453 187.0
[M+Na-2H]- 227.10535 152.1
[M]+ 206.13013 152.1
[M]- 206.13123 152.1
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