Guaiazulene

Guaiazulene bmse001253 - Data

Guaiazulene synonyms

Wikipedia:

Graphical representations:

Guaiazulene

View large 3D structure

Molecular Formula: C15H18

Natural Isotopic Abundance Mass: 198.30342

Mono-Isotopic Molecular Masses:

  • C12N14: 198.140850576
  • C13N14: 213.191173146
  • C12N15: 198.140850576
  • C13N15: 213.191173146

InChI string: InChI=1S/C15H18/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h5-10H,1-4H3

IUPAC: 1,4-dimethyl-7-propan-2-ylazulene

PubChem Compound (CID): 3515
NSC:

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)