CID 2759985

2-(4-methylphenyl)cyclohexan-1-ol

Structural Information

Molecular Formula
C13H18O
SMILES
CC1=CC=C(C=C1)C2CCCCC2O
InChI
InChI=1S/C13H18O/c1-10-6-8-11(9-7-10)12-4-2-3-5-13(12)14/h6-9,12-14H,2-5H2,1H3
InChIKey
RQYIVDKZUCZTSO-UHFFFAOYSA-N
Compound name
2-(4-methylphenyl)cyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

190.13577 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.14305 143.8
[M+Na]+ 213.12499 157.0
[M+NH4]+ 208.16959 153.6
[M+K]+ 229.09893 149.3
[M-H]- 189.12849 148.6
[M+Na-2H]- 211.11044 151.7
[M]+ 190.13522 147.1
[M]- 190.13632 147.1
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