CID 3065072

106609-32-9

Structural Information

Molecular Formula
C19H29NO
SMILES
CC1=CC(=C(C=C1CN2CCCCC2)C3CCCCC3)O
InChI
InChI=1S/C19H29NO/c1-15-12-19(21)18(16-8-4-2-5-9-16)13-17(15)14-20-10-6-3-7-11-20/h12-13,16,21H,2-11,14H2,1H3
InChIKey
NXKVSFDJBAYCGR-UHFFFAOYSA-N
Compound name
2-cyclohexyl-5-methyl-4-(piperidin-1-ylmethyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.2249 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.232176 173.0
[M+Na]+ 310.214118 174.8
[M-H]- 286.217624 177.9
[M+NH4]+ 305.258723 185.9
[M+K]+ 326.188058 169.8
[M+H-H2O]+ 270.222160 163.4
[M+HCOO]- 332.223101 185.7
[M+CH3COO]- 346.238751 181.1
[M+Na-2H]- 308.199566 172.0
[M]+ 287.22435142 163.7
[M]- 287.22544858 163.7
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

No patent data available for this compound.