CID 12747032

42270-35-9

Structural Information

Molecular Formula

C₁₀H₂₂N₂

SMILES

CN(C)CCCC1CCNCC1

InChI

InChI=1S/C10H22N2/c1-12(2)9-3-4-10-5-7-11-8-6-10/h10-11H,3-9H2,1-2H3

InChIKey

PQBXNISKCYCRRG-UHFFFAOYSA-N

Compound name

N,N-dimethyl-3-piperidin-4-ylpropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 28
Patents: 170.1783 Da
Monoisotopic Mass: 1.3
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]+	171.185576	143.1
[M+Na]+	193.167518	145.8
[M-H]-	169.171024	143.8
[M+NH4]+	188.212123	161.5
[M+K]+	209.141458	144.7
[M+H-H2O]+	153.175560	135.9
[M+HCOO]-	215.176501	161.6
[M+CH3COO]-	229.192151	183.8
[M+Na-2H]-	191.152966	146.8
[M]+	170.17775142	138.1
[M]-	170.17884858	138.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe