CID 81647

2,6-dicyclohexyl-p-cresol

Structural Information

Molecular Formula
C19H28O
SMILES
CC1=CC(=C(C(=C1)C2CCCCC2)O)C3CCCCC3
InChI
InChI=1S/C19H28O/c1-14-12-17(15-8-4-2-5-9-15)19(20)18(13-14)16-10-6-3-7-11-16/h12-13,15-16,20H,2-11H2,1H3
InChIKey
RCALTZPFYQMVGL-UHFFFAOYSA-N
Compound name
2,6-dicyclohexyl-4-methylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

679
Patents

272.21402 Da
Monoisotopic Mass

7.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.221296 168.0
[M+Na]+ 295.203238 169.9
[M-H]- 271.206744 174.5
[M+NH4]+ 290.247843 183.0
[M+K]+ 311.177178 165.1
[M+H-H2O]+ 255.211280 159.7
[M+HCOO]- 317.212221 182.0
[M+CH3COO]- 331.227871 176.9
[M+Na-2H]- 293.188686 167.1
[M]+ 272.21347142 158.2
[M]- 272.21456858 158.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe