CID 44145681

93892-59-2

Structural Information

Molecular Formula
C15H24O2
SMILES
CC1C2CC(C1C(C(C)(C)C)OC(=O)C)C=C2
InChI
InChI=1S/C15H24O2/c1-9-11-6-7-12(8-11)13(9)14(15(3,4)5)17-10(2)16/h6-7,9,11-14H,8H2,1-5H3
InChIKey
JFYIRKUBSCIWCU-UHFFFAOYSA-N
Compound name
[2,2-dimethyl-1-(3-methyl-2-bicyclo[2.2.1]hept-5-enyl)propyl] acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.17763 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.184906 161.9
[M+Na]+ 259.166848 168.2
[M-H]- 235.170354 164.8
[M+NH4]+ 254.211453 185.4
[M+K]+ 275.140788 166.7
[M+H-H2O]+ 219.174890 158.4
[M+HCOO]- 281.175831 179.6
[M+CH3COO]- 295.191481 195.3
[M+Na-2H]- 257.152296 161.4
[M]+ 236.17708142 164.3
[M]- 236.17817858 164.3
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.