P-coumaryl Alcohol

P-coumaryl Alcohol bmse000592 - Data bmse010083 - Data bmse010287 - Data

P_coumaryl_alcohol synonyms

4-Coumaryl alcohol; 4-(3-hydroxyprop-1-en-1-yl)phenol; p-Coumaryl alcohol; 4-Hydroxycinnamyl alcohol

Wikipedia:

Graphical representations:

p_coumaryl_alcohol

View large 3D structure

Molecular Formula: C9H10O2

Natural Isotopic Abundance Mass: 150.1745

Mono-Isotopic Molecular Masses:

  • C12N14: 150.0680795652
  • C13N14: 159.0982731054
  • C12N15: 150.0680795652
  • C13N15: 159.0982731054

InChI string: InChI=1S/C9H10O2/c10-7-1-2-8-3-5-9(11)6-4-8/h1-6,10-11H,7H2/b2-1+

PubChem Compound (CID): 5280535
CAS Registry number: 3690-05-9
ChEBI: CHEBI:28386
ZINC: ZINC01529484
ChemSpider: 4444166
KEGG Compound ID: C02646
MMCD: cq_01618

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)