CID 64249718

2-(3-methylcyclohexyl)cyclohexan-1-ol

Structural Information

Molecular Formula
C13H24O
SMILES
CC1CCCC(C1)C2CCCCC2O
InChI
InChI=1S/C13H24O/c1-10-5-4-6-11(9-10)12-7-2-3-8-13(12)14/h10-14H,2-9H2,1H3
InChIKey
YJRKICUHINGZKG-UHFFFAOYSA-N
Compound name
2-(3-methylcyclohexyl)cyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.18271 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.189986 148.8
[M+Na]+ 219.171928 151.0
[M-H]- 195.175434 152.4
[M+NH4]+ 214.216533 167.1
[M+K]+ 235.145868 148.3
[M+H-H2O]+ 179.179970 142.4
[M+HCOO]- 241.180911 163.4
[M+CH3COO]- 255.196561 182.9
[M+Na-2H]- 217.157376 149.4
[M]+ 196.18216142 139.2
[M]- 196.18325858 139.2
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.