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acetylsalicylate

Go to external page http://purl.obolibrary.org/obo/CHEBI_13719

A benzoate that is the conjugate base of acetylsalicylic acid, arising from deprotonation of the carboxy group.

Term info

Label

acetylsalicylate

Synonyms
  • 2-(acetyloxy)benzoate
  • acetylsalicylate
database cross reference
Subsets

3_STAR

IUPAC NAME
2-(acetyloxy)benzoate [ IUPAC ]

charge

-1

formula

C9H7O4

has obo namespace

chebi_ontology

id

CHEBI:13719

inchi

InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)/p-1

inchikey

BSYNRYMUTXBXSQ-UHFFFAOYSA-M

mass

179.14948

monoisotopicmass

179.03498

smiles

CC(=O)Oc1ccccc1C([O-])=O