<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-09-22 08:05:25 UTC</creation_date>
  <update_date>2026-09-22 08:06:09 UTC</update_date>
  <accession>FDB117937</accession>
  <name>(R,S)-N-Nitroso Anatabine</name>
  <description/>
  <synonyms>
    <synonym>3-(1-nitroso-3,6-dihydro-2H-pyridin-2-yl)pyridine</synonym>
  </synonyms>
  <chemical_formula>C10H11N3O</chemical_formula>
  <average_molecular_weight>189.21</average_molecular_weight>
  <monisotopic_moleculate_weight>189.090211983</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number/>
  <smiles>C1C=CCN(C1C2=CN=CC=C2)N=O</smiles>
  <inchi>InChI=1S/C10H11N3O/c14-12-13-7-2-1-5-10(13)9-4-3-6-11-8-9/h1-4,6,8,10H,5,7H2</inchi>
  <inchikey>ZJOFAFWTOKDIFH-UHFFFAOYSA-N</inchikey>
  <taxonomy>
  </taxonomy>
  <state/>
  <predicted_properties>
  </predicted_properties>
  <experimental_properties>
  </experimental_properties>
  <property>
    <kind>average_mass</kind>
    <value>189.21</value>
    <source>ChemAxon</source>
  </property>
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    <kind>mono_mass</kind>
    <value>189.090211983</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>smiles</kind>
    <value>C1C=CCN(C1C2=CN=CC=C2)N=O</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>formula</kind>
    <value>C10H11N3O</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>inchi</kind>
    <value>InChI=1S/C10H11N3O/c14-12-13-7-2-1-5-10(13)9-4-3-6-11-8-9/h1-4,6,8,10H,5,7H2</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>inchikey</kind>
    <value>ZJOFAFWTOKDIFH-UHFFFAOYSA-N</value>
    <source>ChemAxon</source>
  </property>
  <pathways>
  </pathways>
  <spectra>
  </spectra>
  <hmdb_id/>
  <pubchem_compound_id/>
  <chemspider_id/>
  <kegg_id/>
  <chebi_id/>
  <biocyc_id/>
  <het_id/>
  <wikipidia/>
  <vmh_id/>
  <fbonto_id/>
  <foodb_id/>
  <general_references>
  </general_references>
  <foods>
  </foods>
  <flavors>
  </flavors>
  <enzymes>
  </enzymes>
  <health_effects>
  </health_effects>
</compound>
