CID 209522

19974-75-5

Structural Information

Molecular Formula
C19H29NO
SMILES
CN1CCCC(C1C(C2CCCCC2)C3=CC=CC=C3)O
InChI
InChI=1S/C19H29NO/c1-20-14-8-13-17(21)19(20)18(15-9-4-2-5-10-15)16-11-6-3-7-12-16/h2,4-5,9-10,16-19,21H,3,6-8,11-14H2,1H3
InChIKey
UECYONYWHDUNFC-UHFFFAOYSA-N
Compound name
2-[cyclohexyl(phenyl)methyl]-1-methylpiperidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.2249 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.232176 172.7
[M+Na]+ 310.214118 173.2
[M-H]- 286.217624 177.3
[M+NH4]+ 305.258723 185.2
[M+K]+ 326.188058 168.7
[M+H-H2O]+ 270.222160 163.1
[M+HCOO]- 332.223101 184.3
[M+CH3COO]- 346.238751 180.3
[M+Na-2H]- 308.199566 171.3
[M]+ 287.22435142 162.4
[M]- 287.22544858 162.4
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.