(4-chlorophenyl)-thiomorpholin-4-ylmethanone

(4-chlorophenyl)-thiomorpholin-4-ylmethanone bmse011204 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

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Molecular Formula: C11H12ClNOS

Natural Isotopic Abundance Mass: 241.7370799999999

Mono-Isotopic Molecular Masses:

  • C12N14: 241.032812689
  • C13N14: 252.06971590700005
  • C12N15: 242.029847582
  • C13N15: 253.06675080000005

InChI string: InChI=1S/C11H12ClNOS/c12-10-3-1-9(2-4-10)11(14)13-5-7-15-8-6-13/h1-4H,5-8H2

IUPAC: (4-chlorophenyl)-thiomorpholin-4-ylmethanone

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)