3,5-di-tert-Butyl-4-hydroxyacetophenone (CHEBI:183278)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	3,5-di-tert-Butyl-4-hydroxyacetophenone

ChEBI ID	CHEBI:183278

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H24O2

Net Charge

Average Mass

248.366

Monoisotopic Mass

248.17763

InChI

InChI=1S/C16H24O2/c1-10(17)11-8-12(15(2,3)4)14(18)13(9-11)16(5,6)7/h8-9,18H,1-7H3

InChIKey

WGJPGMJLARWHRK-UHFFFAOYSA-N

SMILES

OC1=C(C(C)(C)C)C=C(C=C1C(C)(C)C)C(=O)C

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in blood plasma (BTO:0000131). See: MetaboLights Study

ChEBI Ontology
Outgoing	3,5-di-tert-Butyl-4-hydroxyacetophenone (CHEBI:183278) is a aromatic ketone (CHEBI:76224)

IUPAC Name

1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone