CID 24706238

1-(sec-butyl)piperidin-4-amine

Structural Information

Molecular Formula

C₉H₂₀N₂

SMILES

CCC(C)N1CCC(CC1)N

InChI

InChI=1S/C9H20N2/c1-3-8(2)11-6-4-9(10)5-7-11/h8-9H,3-7,10H2,1-2H3

InChIKey

DBBKREWGWFNQHZ-UHFFFAOYSA-N

Compound name

1-butan-2-ylpiperidin-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 156.16264 Da
Monoisotopic Mass: 1.2
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]+	157.169916	138.9
[M+Na]+	179.151858	143.0
[M-H]-	155.155364	139.7
[M+NH4]+	174.196463	158.0
[M+K]+	195.125798	141.9
[M+H-H2O]+	139.159900	132.3
[M+HCOO]-	201.160841	157.2
[M+CH3COO]-	215.176491	181.2
[M+Na-2H]-	177.137306	141.3
[M]+	156.16209142	132.9
[M]-	156.16318858	132.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe