CID 78540

2,6-dicyclohexylphenol

Structural Information

Molecular Formula
C18H26O
SMILES
C1CCC(CC1)C2=C(C(=CC=C2)C3CCCCC3)O
InChI
InChI=1S/C18H26O/c19-18-16(14-8-3-1-4-9-14)12-7-13-17(18)15-10-5-2-6-11-15/h7,12-15,19H,1-6,8-11H2
InChIKey
AUEZNTKYSSUTGZ-UHFFFAOYSA-N
Compound name
2,6-dicyclohexylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

350
Patents

258.19836 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.20564 163.6
[M+Na]+ 281.18758 164.9
[M-H]- 257.19108 169.9
[M+NH4]+ 276.23218 178.8
[M+K]+ 297.16152 160.3
[M+H-H2O]+ 241.19562 155.2
[M+HCOO]- 303.19656 178.0
[M+CH3COO]- 317.21221 172.6
[M+Na-2H]- 279.17303 163.9
[M]+ 258.19781 153.0
[M]- 258.19891 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.