CID 519743

Seychellene

Structural Information

Molecular Formula
C15H24
SMILES
CC1CCC2(C(=C)C3CCC2(C1C3)C)C
InChI
InChI=1S/C15H24/c1-10-5-7-14(3)11(2)12-6-8-15(14,4)13(10)9-12/h10,12-13H,2,5-9H2,1,3-4H3
InChIKey
QQWUXXGYAQMTAT-UHFFFAOYSA-N
Compound name
3,6,8-trimethyl-2-methylidenetricyclo[5.3.1.03,8]undecane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

7
References

106
Patents

204.1878 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.19508 149.3
[M+Na]+ 227.17702 154.2
[M-H]- 203.18052 148.2
[M+NH4]+ 222.22162 177.1
[M+K]+ 243.15096 149.7
[M+H-H2O]+ 187.18506 143.1
[M+HCOO]- 249.18600 157.5
[M+CH3COO]- 263.20165 159.5
[M+Na-2H]- 225.16247 157.1
[M]+ 204.18725 146.9
[M]- 204.18835 146.9
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