CID 564746

4,8,8-trimethyl-2-methylene-4-vinylbicyclo[5.2.0]nonane

Structural Information

Molecular Formula
C15H24
SMILES
CC1(CC2C1CCC(CC2=C)(C)C=C)C
InChI
InChI=1S/C15H24/c1-6-15(5)8-7-13-12(11(2)9-15)10-14(13,3)4/h6,12-13H,1-2,7-10H2,3-5H3
InChIKey
FITHEODIIYWPLM-UHFFFAOYSA-N
Compound name
4-ethenyl-4,8,8-trimethyl-2-methylidenebicyclo[5.2.0]nonane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1
Patents

204.1878 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.195076 147.5
[M+Na]+ 227.177018 152.8
[M-H]- 203.180524 153.1
[M+NH4]+ 222.221623 164.6
[M+K]+ 243.150958 153.2
[M+H-H2O]+ 187.185060 141.6
[M+HCOO]- 249.186001 163.6
[M+CH3COO]- 263.201651 195.4
[M+Na-2H]- 225.162466 150.6
[M]+ 204.18725142 150.6
[M]- 204.18834858 150.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe