CID 109171

68140-56-7

Structural Information

Molecular Formula
C13H20O2
SMILES
CCOC(=O)C1CC2CC1C3C2CCC3
InChI
InChI=1S/C13H20O2/c1-2-15-13(14)12-7-8-6-11(12)10-5-3-4-9(8)10/h8-12H,2-7H2,1H3
InChIKey
LSYHEHNUOBEHMG-UHFFFAOYSA-N
Compound name
ethyl tricyclo[5.2.1.02,6]decane-8-carboxylate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

208.14633 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.15361 149.3
[M+Na]+ 231.13555 156.0
[M+NH4]+ 226.18015 158.8
[M+K]+ 247.10949 155.8
[M-H]- 207.13905 149.2
[M+Na-2H]- 229.12100 147.9
[M]+ 208.14578 149.8
[M]- 208.14688 149.8
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

No patent data available for this compound.