CID 21159022

Bicyclogermacrene

Structural Information

Molecular Formula
C15H24
SMILES
C/C/1=C/CC/C(=C\C2C(C2(C)C)CC1)/C
InChI
InChI=1S/C15H24/c1-11-6-5-7-12(2)10-14-13(9-8-11)15(14,3)4/h6,10,13-14H,5,7-9H2,1-4H3/b11-6-,12-10-
InChIKey
VPDZRSSKICPUEY-SUYBHAEQSA-N
Compound name
(2Z,6Z)-3,7,11,11-tetramethylbicyclo[8.1.0]undeca-2,6-diene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

301
Patents

204.1878 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.19508 143.2
[M+Na]+ 227.17702 157.5
[M+NH4]+ 222.22162 154.4
[M+K]+ 243.15096 149.4
[M-H]- 203.18052 153.7
[M+Na-2H]- 225.16247 153.2
[M]+ 204.18725 149.5
[M]- 204.18835 149.5
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

No patent data available for this compound.