CID 246548

7249-82-3

Structural Information

Molecular Formula

C₁₅H₂₈N₂

SMILES

CCN(CC)CCCC#CCN1CCCCC1

InChI

InChI=1S/C15H28N2/c1-3-16(4-2)12-8-5-6-9-13-17-14-10-7-11-15-17/h3-5,7-8,10-15H2,1-2H3

InChIKey

JSMYVEANMICDFU-UHFFFAOYSA-N

Compound name

N,N-diethyl-6-piperidin-1-ylhex-4-yn-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 236.22525 Da
Monoisotopic Mass: 2.8
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]+	237.23253	162.6
[M+Na]+	259.21447	171.5
[M+NH4]+	254.25907	166.8
[M+K]+	275.18841	161.0
[M-H]-	235.21797	156.6
[M+Na-2H]-	257.19992	163.6
[M]+	236.22470	161.2
[M]-	236.22580	161.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe