CHEBI:167069 - Ethynylbenzene

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ChEBI Name Ethynylbenzene
ChEBI ID CHEBI:167069
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C8H6
Net Charge 0
Average Mass 102.136
Monoisotopic Mass 102.04695
InChI InChI=1S/C8H6/c1-2-8-6-4-3-5-7-8/h1,3-7H
InChIKey UEXCJVNBTNXOEH-UHFFFAOYSA-N
SMILES C1(=CC=CC=C1)C#C
Metabolite of Species Details
Tuber magnatum (NCBI:txid42249) Found in fruit body (BTO:0000487). of strain Tuber magnatum Pico See: MetaboLights Study
ChEBI Ontology
Outgoing Ethynylbenzene (CHEBI:167069) is a benzenes (CHEBI:22712)
IUPAC Name
ethynylbenzene
Manual Xref Database
10364 ChemSpider
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Registry Number Type Source
536-74-3 CAS Registry Number ChemIDplus