CID 212355

24227-05-2

Structural Information

Molecular Formula
C20H31NO2
SMILES
COC(C1CCCCC1N2CCCCC2)(C3=CC=CC=C3)OC
InChI
InChI=1S/C20H31NO2/c1-22-20(23-2,17-11-5-3-6-12-17)18-13-7-8-14-19(18)21-15-9-4-10-16-21/h3,5-6,11-12,18-19H,4,7-10,13-16H2,1-2H3
InChIKey
QGXUPXDFNVRXFN-UHFFFAOYSA-N
Compound name
1-[2-[dimethoxy(phenyl)methyl]cyclohexyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

317.23547 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 318.24275 180.7
[M+Na]+ 340.22469 191.7
[M+NH4]+ 335.26929 189.0
[M+K]+ 356.19863 184.0
[M-H]- 316.22819 185.9
[M+Na-2H]- 338.21014 188.0
[M]+ 317.23492 183.7
[M]- 317.23602 183.7
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.