(2-oxo-4-propylchromen-7-yl) Acetate

(2-oxo-4-propylchromen-7-yl) Acetate bmse011375 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

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Molecular Formula: C14H14O4

Natural Isotopic Abundance Mass: 246.25855999999987

Mono-Isotopic Molecular Masses:

  • C12N14: 246.089208928
  • C13N14: 260.1361766600002
  • C12N15: 246.089208928
  • C13N15: 260.1361766600002

InChI string: InChI=1S/C14H14O4/c1-3-4-10-7-14(16)18-13-8-11(17-9(2)15)5-6-12(10)13/h5-8H,3-4H2,1-2H3

IUPAC: (2-oxo-4-propylchromen-7-yl) acetate

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)