1-cyclohexyl-3-(furan-2-ylmethyl)urea

1-cyclohexyl-3-(furan-2-ylmethyl)urea bmse011674 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

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Molecular Formula: C12H18N2O2

Natural Isotopic Abundance Mass: 222.28351999999984

Mono-Isotopic Molecular Masses:

  • C12N14: 222.136827826
  • C13N14: 234.17708588200006
  • C12N15: 224.130897612
  • C13N15: 236.17115566800007

InChI string: InChI=1S/C12H18N2O2/c15-12(13-9-11-7-4-8-16-11)14-10-5-2-1-3-6-10/h4,7-8,10H,1-3,5-6,9H2,(H2,13,14,15)

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)