CID 16776189

926219-84-3

Structural Information

Molecular Formula

C₉H₂₁N₃

SMILES

CN(C)CCN1CCC(CC1)N

InChI

InChI=1S/C9H21N3/c1-11(2)7-8-12-5-3-9(10)4-6-12/h9H,3-8,10H2,1-2H3

InChIKey

AZYRNUFWKGIZLZ-UHFFFAOYSA-N

Compound name

1-[2-(dimethylamino)ethyl]piperidin-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 17
Patents: 171.17355 Da
Monoisotopic Mass: -0.1
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]+	172.18083	141.1
[M+Na]+	194.16277	149.7
[M+NH4]+	189.20737	149.3
[M+K]+	210.13671	144.2
[M-H]-	170.16627	143.7
[M+Na-2H]-	192.14822	145.5
[M]+	171.17300	142.7
[M]-	171.17410	142.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe