(2S)-2-(4-phenylphenoxy)propanoic Acid

(2S)-2-(4-phenylphenoxy)propanoic Acid bmse011073 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

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Molecular Formula: C15H14O3

Natural Isotopic Abundance Mass: 242.26985999999985

Mono-Isotopic Molecular Masses:

  • C12N14: 242.094294308
  • C13N14: 257.14461687800014
  • C12N15: 242.094294308
  • C13N15: 257.14461687800014

InChI string: InChI=1S/C15H14O3/c1-11(15(16)17)18-14-9-7-13(8-10-14)12-5-3-2-4-6-12/h2-11H,1H3,(H,16,17)/t11-/m0/s1

IUPAC: (2S)-2-(4-phenylphenoxy)propanoic acid

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)