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]+ 251.23694 165.4
[M+Na]+ 273.21888 171.2
[M-H]- 249.22238 169.8
[M+NH4]+ 268.26348 188.1
[M+K]+ 289.19282 166.8
[M+H-H2O]+ 233.22692 161.4
[M+HCOO]- 295.22786 179.7
[M+CH3COO]- 309.24351 198.6
[M+Na-2H]- 271.20433 160.4
[M]+ 250.22911 161.0
[M]- 250.23021 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.