CID 3056592

73806-57-2

Structural Information

Molecular Formula
C18H27NO2
SMILES
COC1=CC=CC(=C1)C2(CCCCC2N3CCCCC3)O
InChI
InChI=1S/C18H27NO2/c1-21-16-9-7-8-15(14-16)18(20)11-4-3-10-17(18)19-12-5-2-6-13-19/h7-9,14,17,20H,2-6,10-13H2,1H3
InChIKey
ORKFAZQCILBALN-UHFFFAOYSA-N
Compound name
1-(3-methoxyphenyl)-2-piperidin-1-ylcyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

289.2042 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.21148 172.4
[M+Na]+ 312.19342 174.6
[M-H]- 288.19692 177.5
[M+NH4]+ 307.23802 186.9
[M+K]+ 328.16736 170.8
[M+H-H2O]+ 272.20146 162.9
[M+HCOO]- 334.20240 185.6
[M+CH3COO]- 348.21805 180.8
[M+Na-2H]- 310.17887 173.6
[M]+ 289.20365 164.1
[M]- 289.20475 164.1
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

No patent data available for this compound.