CID 139594869

Ns00009678

Structural Information

Molecular Formula
C18H26O
SMILES
C1CCC(CC1)C2=CC(=CC=C2)C3CCC(CC3)O
InChI
InChI=1S/C18H26O/c19-18-11-9-15(10-12-18)17-8-4-7-16(13-17)14-5-2-1-3-6-14/h4,7-8,13-15,18-19H,1-3,5-6,9-12H2
InChIKey
FDPJCOQMIYJDTL-UHFFFAOYSA-N
Compound name
4-(3-cyclohexylphenyl)cyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.19836 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.205636 163.6
[M+Na]+ 281.187578 164.9
[M-H]- 257.191084 169.9
[M+NH4]+ 276.232183 178.8
[M+K]+ 297.161518 160.3
[M+H-H2O]+ 241.195620 155.2
[M+HCOO]- 303.196561 178.0
[M+CH3COO]- 317.212211 172.6
[M+Na-2H]- 279.173026 163.9
[M]+ 258.19781142 153.0
[M]- 258.19890858 153.0
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.