1-(thiophen-3-ylmethyl)piperidin-4-ol

1-(thiophen-3-ylmethyl)piperidin-4-ol bmse011274 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

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Molecular Formula: C10H15NOS

Natural Isotopic Abundance Mass: 197.29719999999986

Mono-Isotopic Molecular Masses:

  • C12N14: 197.087435105
  • C13N14: 207.12098348500004
  • C12N15: 198.084469998
  • C13N15: 208.11801837800004

InChI string: InChI=1S/C10H15NOS/c12-10-1-4-11(5-2-10)7-9-3-6-13-8-9/h3,6,8,10,12H,1-2,4-5,7H2

wwPDB CCD: T0Y

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)