CID 10374713

N-hydroxy-n-acetylcadaverine

Structural Information

Molecular Formula

C₇H₁₆N₂O₂

SMILES

CC(=O)N(CCCCCN)O

InChI

InChI=1S/C7H16N2O2/c1-7(10)9(11)6-4-2-3-5-8/h11H,2-6,8H2,1H3

InChIKey

ATUUAJPBSMFUFR-UHFFFAOYSA-N

Compound name

N-(5-aminopentyl)-N-hydroxyacetamide

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 3
References: 6
Patents: 160.12119 Da
Monoisotopic Mass: -0.6
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]+	161.12847	137.7
[M+Na]+	183.11041	142.6
[M-H]-	159.11391	137.3
[M+NH4]+	178.15501	157.6
[M+K]+	199.08435	142.9
[M+H-H2O]+	143.11845	131.9
[M+HCOO]-	205.11939	161.2
[M+CH3COO]-	219.13504	183.4
[M+Na-2H]-	181.09586	140.9
[M]+	160.12064	137.4
[M]-	160.12174	137.4

Literature stripe

literature stripe

Patent stripe

patents stripe