Biological Magnetic Resonance Data Bank

A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB


N-(4-aminobutyl)acetamide synonyms

N-Acetylputrescine hydrochloride


Graphical representations:


View large 3D structure

Molecular Formula: C6H14N2O

Natural Isotopic Abundance Mass: 130.18816

Mono-Isotopic Molecular Masses:

  • C12N14: 130.110613078
  • C13N14: 136.130742106
  • C12N15: 132.104682864
  • C13N15: 138.124811892

InChI string: InChI=1S/C6H14N2O/c1-6(9)8-5-3-2-4-7/h2-5,7H2,1H3,(H,8,9)

MMCD: cq_01651
PubChem Compound (CID): 122356

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73,