CID 33069

14156-91-3

Structural Information

Molecular Formula

C₉H₂₀N₂

SMILES

CC1CCCN(C1)CCCN

InChI

InChI=1S/C9H20N2/c1-9-4-2-6-11(8-9)7-3-5-10/h9H,2-8,10H2,1H3

InChIKey

ADIQUBKLXXCKLT-UHFFFAOYSA-N

Compound name

3-(3-methylpiperidin-1-yl)propan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 22
Patents: 156.16264 Da
Monoisotopic Mass: 1.0
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]+	157.16992	137.4
[M+Na]+	179.15186	147.2
[M+NH4]+	174.19646	146.0
[M+K]+	195.12580	140.7
[M-H]-	155.15536	139.6
[M+Na-2H]-	177.13731	142.0
[M]+	156.16209	139.2
[M]-	156.16319	139.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe