CID 20069559

46350-29-2

Structural Information

Molecular Formula

C₁₀H₂₄N₄

SMILES

CC(CN1CCN(CC1)CC(C)N)N

InChI

InChI=1S/C10H24N4/c1-9(11)7-13-3-5-14(6-4-13)8-10(2)12/h9-10H,3-8,11-12H2,1-2H3

InChIKey

IMGCATGOHBXHNA-UHFFFAOYSA-N

Compound name

1-[4-(2-aminopropyl)piperazin-1-yl]propan-2-amine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 61
Patents: 200.2001 Da
Monoisotopic Mass: -0.9
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]+	201.207376	152.1
[M+Na]+	223.189318	154.8
[M-H]-	199.192824	150.8
[M+NH4]+	218.233923	167.4
[M+K]+	239.163258	153.4
[M+H-H2O]+	183.197360	144.1
[M+HCOO]-	245.198301	168.2
[M+CH3COO]-	259.213951	192.3
[M+Na-2H]-	221.174766	152.2
[M]+	200.19955142	144.7
[M]-	200.20064858	144.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe