CID 129710140

Spermine monoaldehyde

Structural Information

Molecular Formula

C₁₀H₂₃N₃O

SMILES

C(CCNCCC=O)CNCCCN

InChI

InChI=1S/C10H23N3O/c11-5-3-8-12-6-1-2-7-13-9-4-10-14/h10,12-13H,1-9,11H2

InChIKey

ADZORAWYLNDBGZ-UHFFFAOYSA-N

Compound name

3-[4-(3-aminopropylamino)butylamino]propanal

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 201.18411 Da
Monoisotopic Mass: -1.1
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]+	202.19139	149.0
[M+Na]+	224.17333	155.1
[M+NH4]+	219.21793	155.1
[M+K]+	240.14727	149.1
[M-H]-	200.17683	149.1
[M+Na-2H]-	222.15878	151.1
[M]+	201.18356	149.3
[M]-	201.18466	149.3

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.