CID 22492024

(4-cyclohexylphenyl)methanol

Structural Information

Molecular Formula
C13H18O
SMILES
C1CCC(CC1)C2=CC=C(C=C2)CO
InChI
InChI=1S/C13H18O/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h6-9,12,14H,1-5,10H2
InChIKey
SMHACOFUYOUOBL-UHFFFAOYSA-N
Compound name
(4-cyclohexylphenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

97
Patents

190.13577 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.14305 143.3
[M+Na]+ 213.12499 147.8
[M-H]- 189.12849 147.7
[M+NH4]+ 208.16959 161.9
[M+K]+ 229.09893 144.4
[M+H-H2O]+ 173.13303 136.7
[M+HCOO]- 235.13397 162.5
[M+CH3COO]- 249.14962 180.6
[M+Na-2H]- 211.11044 147.8
[M]+ 190.13522 137.7
[M]- 190.13632 137.7
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

patents stripe