H-b-H5t

H-b-H5t bmse010179 - Data bmse010181 - Data

H_b_H5t synonyms

Wikipedia:

Graphical representations:

H_b_H5t

View large 3D structure

Molecular Formula: C16H18O4

Natural Isotopic Abundance Mass: 274.31172

Mono-Isotopic Molecular Masses:

  • C12N14: 274.1205090662
  • C13N14: 290.174186471
  • C12N15: 274.1205090662
  • C13N15: 290.174186471

InChI string: InChI=1S/C16H18O4/c1-11-2-8-14(9-3-11)20-15(10-17)16(19)12-4-6-13(18)7-5-12/h2-9,15-19H,10H2,1H3/t15-,16-/m0/s1

USDA_NMR_database: 269 271

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)