CID 3047644

Piperidine, 4-cyclohexyl-1-isopropyl-, hydrochloride

Structural Information

Molecular Formula

C₁₄H₂₇N

SMILES

CC(C)N1CCC(CC1)C2CCCCC2

InChI

InChI=1S/C14H27N/c1-12(2)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h12-14H,3-11H2,1-2H3

InChIKey

JZHUVDPQNLUHPX-UHFFFAOYSA-N

Compound name

4-cyclohexyl-1-propan-2-ylpiperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 18
Patents: 209.21436 Da
Monoisotopic Mass: 4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	210.22164	154.6
[M+Na]+	232.20358	155.5
[M-H]-	208.20708	157.5
[M+NH4]+	227.24818	171.3
[M+K]+	248.17752	153.4
[M+H-H2O]+	192.21162	146.5
[M+HCOO]-	254.21256	167.8
[M+CH3COO]-	268.22821	188.8
[M+Na-2H]-	230.18903	154.5
[M]+	209.21381	145.2
[M]-	209.21491	145.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe