2-(3,3,4-trimethylpiperazin-1-yl)ethanamine

2-(3,3,4-trimethylpiperazin-1-yl)ethanamine bmse011565 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

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Molecular Formula: C9H21N3

Natural Isotopic Abundance Mass: 171.2831399999998

Mono-Isotopic Molecular Masses:

  • C12N14: 171.173547687
  • C13N14: 180.20374122900003
  • C12N15: 174.164652366
  • C13N15: 183.19484590800005

InChI string: InChI=1S/C9H21N3/c1-9(2)8-12(5-4-10)7-6-11(9)3/h4-8,10H2,1-3H3

IUPAC: 2-(3,3,4-trimethylpiperazin-1-yl)ethanamine

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, https://www.nature.com/articles/sdata201773)