Erone Diacetate
Erone_diacetate synonyms
3-acetoxy-1-(4-acetoxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)propan-1-one
Graphical representations:
View large 3D structure
Molecular Formula: C21H22O8
Natural Isotopic Abundance Mass: 402.39458
Mono-Isotopic Molecular Masses:
- C12N14: 402.131467683
- C13N14: 423.2019192768
- C12N15: 402.131467683
- C13N15: 423.2019192768
InChI string: InChI=1S/C21H22O8/c1-13(22)27-12-20(29-17-8-6-5-7-16(17)25-3)21(24)15-9-10-18(28-14(2)23)19(11-15)26-4/h5-11,20H,12H2,1-4H3/t20-/m0/s1
USDA_NMR_database: 162Reference 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)