CID 109419

(3,5-dimethylcyclohexyl)methanol

Structural Information

Molecular Formula
C9H18O
SMILES
CC1CC(CC(C1)CO)C
InChI
InChI=1S/C9H18O/c1-7-3-8(2)5-9(4-7)6-10/h7-10H,3-6H2,1-2H3
InChIKey
GEVHTUNKMMCORO-UHFFFAOYSA-N
Compound name
(3,5-dimethylcyclohexyl)methanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

31
Patents

142.13577 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.14305 131.9
[M+Na]+ 165.12499 143.0
[M+NH4]+ 160.16959 141.2
[M+K]+ 181.09893 136.7
[M-H]- 141.12849 134.0
[M+Na-2H]- 163.11044 136.6
[M]+ 142.13522 134.0
[M]- 142.13632 134.0
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

patents stripe