CID 17812503

344436-00-6

Structural Information

Molecular Formula

C₁₀H₂₁N₃

SMILES

CN1CCCC(C1)N2CCNCC2

InChI

InChI=1S/C10H21N3/c1-12-6-2-3-10(9-12)13-7-4-11-5-8-13/h10-11H,2-9H2,1H3

InChIKey

HBGWJGMJKRYBLI-UHFFFAOYSA-N

Compound name

1-(1-methylpiperidin-3-yl)piperazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 183.17355 Da
Monoisotopic Mass: 0.2
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]+	184.18083	147.5
[M+Na]+	206.16277	150.1
[M-H]-	182.16627	146.7
[M+NH4]+	201.20737	161.9
[M+K]+	222.13671	147.2
[M+H-H2O]+	166.17081	138.1
[M+HCOO]-	228.17175	158.9
[M+CH3COO]-	242.18740	156.3
[M+Na-2H]-	204.14822	150.1
[M]+	183.17300	136.5
[M]-	183.17410	136.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe