3-DIETHYLAMINOPHENOL

3-DIETHYLAMINOPHENOL bmse011268 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

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Molecular Formula: C10H15NO

Natural Isotopic Abundance Mass: 165.23219999999986

Mono-Isotopic Molecular Masses:

  • C12N14: 165.115364105
  • C13N14: 175.14891248500004
  • C12N15: 166.112398998
  • C13N15: 176.14594737800005

InChI string: InChI=1S/C10H15NO/c1-3-11(4-2)9-6-5-7-10(12)8-9/h5-8,12H,3-4H2,1-2H3

IUPAC: 3-DIETHYLAMINOPHENOL

wwPDB CCD: O0Y

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)