CID 189087

N-(5-aminopentyl)acetamide

Structural Information

Molecular Formula

C₇H₁₆N₂O

SMILES

CC(=O)NCCCCCN

InChI

InChI=1S/C7H16N2O/c1-7(10)9-6-4-2-3-5-8/h2-6,8H2,1H3,(H,9,10)

InChIKey

RMOIHHAKNOFHOE-UHFFFAOYSA-N

Compound name

N-(5-aminopentyl)acetamide

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 8
References: 405
Patents: 144.12627 Da
Monoisotopic Mass: -0.3
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]+	145.13355	133.3
[M+Na]+	167.11549	141.0
[M+NH4]+	162.16009	140.3
[M+K]+	183.08943	136.1
[M-H]-	143.11899	133.1
[M+Na-2H]-	165.10094	136.0
[M]+	144.12572	133.8
[M]-	144.12682	133.8

Literature stripe

literature stripe

Patent stripe

patents stripe