Methyl Jasmonate

Methyl Jasmonate bmse000551 - Data

Methyl_jasmonate synonyms

Methyl 3-oxo-2-(2-pentenyl)cyclopentaneacetate; Methyl jasmonate; 3-Oxo-2-(2-pentenyl)cyclopentaneacetic acid, methyl ester

Wikipedia:

Graphical representations:

methyl_jasmonate

View large 3D structure

Molecular Formula: C13H20O3

Natural Isotopic Abundance Mass: 224.2961

Mono-Isotopic Molecular Masses:

  • C12N14: 224.1412445083
  • C13N14: 237.1848573997
  • C12N15: 224.1412445083
  • C13N15: 237.1848573997

InChI string: InChI=1S/C13H20O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,10-11H,3,6-9H2,1-2H3/b5-4+/t10-,11-/m1/s1

PubChem Compound (CID): 62388
Sigma-Aldrich: 392707_ALDRICH
ChemSpider: 56176
ChemDB: 4259934
MMCD: cq_08134
MDL: MFCD00151382

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)