CID 138394862

Dtxsid3051961

Structural Information

Molecular Formula
C15H24O
SMILES
C[C@@H]1CC([C@@H]2[C@]13CCC(=C)[C@H](C3)C2(C)C)O
InChI
InChI=1S/C15H24O/c1-9-5-6-15-8-11(9)14(3,4)13(15)12(16)7-10(15)2/h10-13,16H,1,5-8H2,2-4H3/t10-,11+,12?,13+,15+/m1/s1
InChIKey
XXEZIFFYVUWPSP-UXBXGOFWSA-N
Compound name
(1S,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.3.1.01,5]undecan-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.18271 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.18999 152.7
[M+Na]+ 243.17193 161.3
[M+NH4]+ 238.21653 165.3
[M+K]+ 259.14587 154.6
[M-H]- 219.17543 153.8
[M+Na-2H]- 241.15738 155.1
[M]+ 220.18216 154.4
[M]- 220.18326 154.4
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.