CHEBI:88586 - alpha-Trichloromethylbenzyl acetate

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ChEBI Name alpha-Trichloromethylbenzyl acetate ChEBI ID CHEBI:88586 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C10H9Cl3O2 Net Charge 0 Average Mass 267.536 Monoisotopic Mass 265.96681 InChI InChI=1S/C10H9Cl3O2/c1-7(14)15-9(10(11,12)13)8-5-3-2-4-6-8/h2-6,9H,1H3 InChIKey JKRWZLOCPLZZEI-UHFFFAOYSA-N SMILES CC(=O)OC(C1=CC=CC=C1)C(Cl)(Cl)Cl Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in saliva (UBERON:0001836). See: PubMed ChEBI Ontology Outgoing alpha-Trichloromethylbenzyl acetate (CHEBI:88586) has functional parent benzyl alcohol (CHEBI:17987) alpha-Trichloromethylbenzyl acetate (CHEBI:88586) is a carboxylic ester (CHEBI:33308) Synonyms Sources 2,2,2-trichloro-1-phenylethyl acetate HMDB a-trichloromethylbenzyl acetate HMDB a-Trichloromethylbenzyl acetate HMDB a-Trichloromethylbenzyl acetic acid HMDB alpha-trichloromethylbenzyl acetic acid HMDB alpha-Trichloromethylbenzyl acetic acid HMDB Manual Xref Database HMDB0061807 HMDB View more database links Citation Type Source 24421258 PubMed citation Europe PMC