CID 86170

Cyclohexanol, 2-methyl(trimethylbicyclo(2.2.1)hept-2-yl)-

Structural Information

Molecular Formula
C17H30O
SMILES
CC1CC(CCC1O)C2C(C3CC2C(C3C)C)C
InChI
InChI=1S/C17H30O/c1-9-7-13(5-6-16(9)18)17-12(4)14-8-15(17)11(3)10(14)2/h9-18H,5-8H2,1-4H3
InChIKey
SPSKJJDRPGAMOU-UHFFFAOYSA-N
Compound name
2-methyl-4-(3,5,6-trimethyl-2-bicyclo[2.2.1]heptanyl)cyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

250.22966 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.236936 165.4
[M+Na]+ 273.218878 171.2
[M-H]- 249.222384 169.8
[M+NH4]+ 268.263483 188.1
[M+K]+ 289.192818 166.8
[M+H-H2O]+ 233.226920 161.4
[M+HCOO]- 295.227861 179.7
[M+CH3COO]- 309.243511 198.6
[M+Na-2H]- 271.204326 160.4
[M]+ 250.22911142 161.0
[M]- 250.23020858 161.0
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.