CHEBI:9627 - Tolylacetate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Tolylacetate
ChEBI ID CHEBI:9627
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C9H10O2
Net Charge 0
Average Mass 150.175
Monoisotopic Mass 150.06808
InChI InChI=1S/C9H10O2/c1-7-3-5-9(6-4-7)11-8(2)10/h3-6H,1-2H3
InChIKey CDJJKTLOZJAGIZ-UHFFFAOYSA-N
SMILES CC(=O)Oc1ccc(C)cc1
ChEBI Ontology
Outgoing Tolylacetate (CHEBI:9627) is a benzoate ester (CHEBI:36054)
Tolylacetate (CHEBI:9627) is a phenols (CHEBI:33853)
Synonyms Sources
p-Cresyl acetate KEGG COMPOUND
p-Tolyacetate KEGG COMPOUND
Tolylacetate KEGG COMPOUND
Manual Xrefs Databases
C01963 KEGG COMPOUND
HMDB0032075 HMDB
View more database links
Registry Number Type Source
140-39-6 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014