CID 10655819

Selina-4(15),7(11)-diene

Structural Information

Molecular Formula
C15H24
SMILES
CC(=C1CC[C@]2(CCCC(=C)[C@@H]2C1)C)C
InChI
InChI=1S/C15H24/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h14H,3,5-10H2,1-2,4H3/t14-,15+/m0/s1
InChIKey
RMZHSBMIZBMVMN-LSDHHAIUSA-N
Compound name
(4aS,8aR)-8a-methyl-4-methylidene-6-propan-2-ylidene-2,3,4a,5,7,8-hexahydro-1H-naphthalene
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1
References

310
Patents

204.1878 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.195076 150.0
[M+Na]+ 227.177018 154.3
[M-H]- 203.180524 153.1
[M+NH4]+ 222.221623 172.2
[M+K]+ 243.150958 150.7
[M+H-H2O]+ 187.185060 144.8
[M+HCOO]- 249.186001 164.5
[M+CH3COO]- 263.201651 189.0
[M+Na-2H]- 225.162466 151.6
[M]+ 204.18725142 142.3
[M]- 204.18834858 142.3
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