CID 3048076

Piperidine, 1-((4-methoxy-4-m-tolyl)cyclohexyl)-

Structural Information

Molecular Formula
C19H29NO
SMILES
CC1=CC(=CC=C1)C2(CCC(CC2)N3CCCCC3)OC
InChI
InChI=1S/C19H29NO/c1-16-7-6-8-17(15-16)19(21-2)11-9-18(10-12-19)20-13-4-3-5-14-20/h6-8,15,18H,3-5,9-14H2,1-2H3
InChIKey
ROLOQLFLZPBXLY-UHFFFAOYSA-N
Compound name
1-[4-methoxy-4-(3-methylphenyl)cyclohexyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.2249 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.232176 173.1
[M+Na]+ 310.214118 175.4
[M-H]- 286.217624 179.4
[M+NH4]+ 305.258723 188.5
[M+K]+ 326.188058 171.6
[M+H-H2O]+ 270.222160 163.2
[M+HCOO]- 332.223101 187.3
[M+CH3COO]- 346.238751 182.0
[M+Na-2H]- 308.199566 174.1
[M]+ 287.22435142 165.5
[M]- 287.22544858 165.5
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.