N-methyl-1-(1-phenylpyrazol-4-yl)methanamine

N-methyl-1-(1-phenylpyrazol-4-yl)methanamine bmse011449 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

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Molecular Formula: C11H13N3

Natural Isotopic Abundance Mass: 187.24101999999988

Mono-Isotopic Molecular Masses:

  • C12N14: 187.110947431
  • C13N14: 198.14785064900005
  • C12N15: 190.10205211000002
  • C13N15: 201.13895532800007

InChI string: InChI=1S/C11H13N3/c1-12-7-10-8-13-14(9-10)11-5-3-2-4-6-11/h2-6,8-9,12H,7H2,1H3

IUPAC: N-methyl-1-(1-phenylpyrazol-4-yl)methanamine

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)