2-imidazol-1-ylethyl N,N-dimethylcarbamate

2-imidazol-1-ylethyl N,N-dimethylcarbamate bmse011630 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

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Molecular Formula: C8H13N3O2

Natural Isotopic Abundance Mass: 183.20771999999988

Mono-Isotopic Molecular Masses:

  • C12N14: 183.100776671
  • C13N14: 191.12761537500003
  • C12N15: 186.09188135000002
  • C13N15: 194.11872005400005

InChI string: InChI=1S/C8H13N3O2/c1-10(2)8(12)13-6-5-11-4-3-9-7-11/h3-4,7H,5-6H2,1-2H3

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)