CID 257735

Tricyclo(5.2.1.02,6)dec-8-yl formate

Structural Information

Molecular Formula
C11H16O2
SMILES
C1CC2C(C1)C3CC2CC3OC=O
InChI
InChI=1S/C11H16O2/c12-6-13-11-5-7-4-10(11)9-3-1-2-8(7)9/h6-11H,1-5H2
InChIKey
OQWFGJSSTQRQQM-UHFFFAOYSA-N
Compound name
8-tricyclo[5.2.1.02,6]decanyl formate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

180.11504 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.12232 143.6
[M+Na]+ 203.10426 150.8
[M-H]- 179.10776 147.3
[M+NH4]+ 198.14886 171.3
[M+K]+ 219.07820 148.5
[M+H-H2O]+ 163.11230 140.2
[M+HCOO]- 225.11324 163.8
[M+CH3COO]- 239.12889 181.8
[M+Na-2H]- 201.08971 144.7
[M]+ 180.11449 143.1
[M]- 180.11559 143.1
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