CHEBI:228604 - 1-[2-(2,6-dichlorobenzyl)-2H-1,2,3,4-tetraazol-5-yl]piperidine

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ChEBI Name 1-[2-(2,6-dichlorobenzyl)-2H-1,2,3,4-tetraazol-5-yl]piperidine
ChEBI ID CHEBI:228604
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H15Cl2N5
Net Charge 0
Average Mass 312.200
Monoisotopic Mass 311.07045
InChI InChI=1S/C13H15Cl2N5/c14-11-5-4-6-12(15)10(11)9-20-17-13(16-18-20)19-7-2-1-3-8-19/h4-6H,1-3,7-9H2
InChIKey ZSQSOJBJMRFENS-UHFFFAOYSA-N
SMILES ClC1=C(CN2N=C(N3CCCCC3)N=N2)C(Cl)=CC=C1
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: MetaboLights Study
ChEBI Ontology
Outgoing 1-[2-(2,6-dichlorobenzyl)-2H-1,2,3,4-tetraazol-5-yl]piperidine (CHEBI:228604) is a dichlorobenzene (CHEBI:23697)
IUPAC Name
1-[2-[(2,6-dichlorophenyl)methyl]tetrazol-5-yl]piperidine
Manual Xref Database
2012007 ChemSpider
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