CID 232446

843-55-0

Structural Information

Molecular Formula
C18H20O2
SMILES
C1CCC(CC1)(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O
InChI
InChI=1S/C18H20O2/c19-16-8-4-14(5-9-16)18(12-2-1-3-13-18)15-6-10-17(20)11-7-15/h4-11,19-20H,1-3,12-13H2
InChIKey
SDDLEVPIDBLVHC-UHFFFAOYSA-N
Compound name
4-[1-(4-hydroxyphenyl)cyclohexyl]phenol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

64
References

60422
Patents

268.14633 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.15361 164.0
[M+Na]+ 291.13555 169.2
[M-H]- 267.13905 170.6
[M+NH4]+ 286.18015 180.4
[M+K]+ 307.10949 163.9
[M+H-H2O]+ 251.14359 156.2
[M+HCOO]- 313.14453 181.6
[M+CH3COO]- 327.16018 174.4
[M+Na-2H]- 289.12100 168.0
[M]+ 268.14578 157.8
[M]- 268.14688 157.8
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