CID 13001872

7398-56-3

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

184
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 149.1
[M+Na]+ 229.11990 155.8
[M+NH4]+ 224.16450 158.3
[M+K]+ 245.09384 155.5
[M-H]- 205.12340 148.7
[M+Na-2H]- 227.10535 147.6
[M]+ 206.13013 149.5
[M]- 206.13123 149.5
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

patents stripe