CID 201007

Piperidine, 1-((1-phenylcyclohexyl)methyl)-

Structural Information

Molecular Formula
C18H27N
SMILES
C1CCC(CC1)(CN2CCCCC2)C3=CC=CC=C3
InChI
InChI=1S/C18H27N/c1-4-10-17(11-5-1)18(12-6-2-7-13-18)16-19-14-8-3-9-15-19/h1,4-5,10-11H,2-3,6-9,12-16H2
InChIKey
CFSQQJQNEJNCFK-UHFFFAOYSA-N
Compound name
1-[(1-phenylcyclohexyl)methyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.21436 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.22164 165.8
[M+Na]+ 280.20358 166.7
[M-H]- 256.20708 171.5
[M+NH4]+ 275.24818 181.7
[M+K]+ 296.17752 162.4
[M+H-H2O]+ 240.21162 155.7
[M+HCOO]- 302.21256 180.1
[M+CH3COO]- 316.22821 174.4
[M+Na-2H]- 278.18903 168.6
[M]+ 257.21381 155.5
[M]- 257.21491 155.5
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.