CHEBI:176693 - Pentylbenzene

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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 Pentylbenzene
ChEBI ID CHEBI:176693
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C11H16
Net Charge 0
Average Mass 148.249
Monoisotopic Mass 148.12520
InChI InChI=1S/C11H16/c1-2-3-5-8-11-9-6-4-7-10-11/h4,6-7,9-10H,2-3,5,8H2,1H3
InChIKey PWATWSYOIIXYMA-UHFFFAOYSA-N
SMILES C(CCC)CC1=CC=CC=C1
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000118). of strain [] See: MetaboLights Study
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000118). of strain [] See: MetaboLights Study
ChEBI Ontology
Outgoing Pentylbenzene (CHEBI:176693) is a benzenes (CHEBI:22712)
IUPAC Name
pentylbenzene
Manual Xrefs Databases
10404 ChemSpider
3H2 PDBeChem
HMDB0059834 HMDB
View more database links
Registry Number Type Source
538-68-1 CAS Registry Number ChemIDplus