3-cyclohexyl-1-morpholin-4-ylpropan-1-one

3-cyclohexyl-1-morpholin-4-ylpropan-1-one bmse011090 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

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Molecular Formula: C13H23NO2

Natural Isotopic Abundance Mass: 225.32721999999978

Mono-Isotopic Molecular Masses:

  • C12N14: 225.172878981
  • C13N14: 238.21649187500006
  • C12N15: 226.169913874
  • C13N15: 239.21352676800007

InChI string: InChI=1S/C13H23NO2/c15-13(14-8-10-16-11-9-14)7-6-12-4-2-1-3-5-12/h12H,1-11H2

IUPAC: 3-cyclohexyl-1-morpholin-4-ylpropan-1-one

wwPDB CCD: NW4

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)