3-(methylsulfanylmethyl)aniline

3-(methylsulfanylmethyl)aniline bmse012592 - Data

3-(methylsulfanylmethyl)aniline synonyms

Wikipedia:

Graphical representations:

3-(methylsulfanylmethyl)aniline

View large 3D structure

Molecular Formula: C8H11NS

Natural Isotopic Abundance Mass: 153.24464

Mono-Isotopic Molecular Masses:

  • C12N14: 153.061220357
  • C13N14: 161.08805906100002
  • C12N15: 154.05825525
  • C13N15: 162.08509395400003

InChI string: InChI=1S/C8H11NS/c1-10-6-7-3-2-4-8(9)5-7/h2-5H,6,9H2,1H3

EU-OPENSCREEN: EOS103405

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)