BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules 		Member of WWPDB

1-[(2R)-2-hydroxypropyl]-3-phenylurea

1-[(2R)-2-hydroxypropyl]-3-phenylurea bmse012418 - Data

1-[(2R)-2-hydroxypropyl]-3-phenylurea synonyms

Wikipedia:

Graphical representations:

1-[(2R)-2-hydroxypropyl]-3-phenylurea

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Molecular Formula: C10H14N2O2

Natural Isotopic Abundance Mass: 194.23036

Mono-Isotopic Molecular Masses:

  • C12N14: 194.105527698
  • C13N14: 204.13907607800004
  • C12N15: 196.09959748400001
  • C13N15: 206.13314586400006

InChI string: InChI=1S/C10H14N2O2/c1-8(13)7-11-10(14)12-9-5-3-2-4-6-9/h2-6,8,13H,7H2,1H3,(H2,11,12,14)/t8-/m1/s1

EU-OPENSCREEN: EOS103172

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)