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<compound>
  <version>1.0</version>
  <creation_date>2026-08-29 18:30:46 UTC</creation_date>
  <update_date>2026-08-29 18:30:46 UTC</update_date>
  <accession/>
  <common_name>1-o-[2-(diethylamino)ethyl] 3-o-ethyl 2-(2-phenylethyl)propanedioate</common_name>
  <class>SmallMolecule</class>
  <description>1-o-[2-(diethylamino)ethyl] 3-o-ethyl 2-(2-phenylethyl)propanedioate is a chemical compound with the formula C19H29NO4 and an average molecular weight of 335.40 g/mol. This substance has been identified in or released from two recorded sources: amplifiers within electrical and electronic equipment, and the preparation of wine or sparkling wine within food, food processing and cookware.</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C19H29NO4</chemical_formula>
  <average_molecular_weight/>
  <monisotopic_moleculate_weight>335.2096584</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number/>
  <smiles>CCN(CC)CCOC(=O)C(CCC1=CC=CC=C1)C(=O)OCC</smiles>
  <inchi>InChI=1S/C19H29NO4/c1-4-20(5-2)14-15-24-19(22)17(18(21)23-6-3)13-12-16-10-8-7-9-11-16/h7-11,17H,4-6,12-15H2,1-3H3</inchi>
  <inchikey>XPHUNOHGEZFKPM-UHFFFAOYSA-N</inchikey>
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    <sub_class/>
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  </taxonomy>
  <status>Detected and Not Quantified</status>
  <origin/>
  <cellular_locations/>
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  <tissue_locations/>
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  <state/>
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  <experimental_properties>
    <property>
      <kind>logp</kind>
      <value>3.6</value>
    </property>
  </experimental_properties>
  <predicted_properties>
    <property>
      <kind>mono_mass</kind>
      <value>335.2096584</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>smiles</kind>
      <value>CCN(CC)CCOC(=O)C(CCC1=CC=CC=C1)C(=O)OCC</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C19H29NO4</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C19H29NO4/c1-4-20(5-2)14-15-24-19(22)17(18(21)23-6-3)13-12-16-10-8-7-9-11-16/h7-11,17H,4-6,12-15H2,1-3H3</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>XPHUNOHGEZFKPM-UHFFFAOYSA-N</value>
      <source>ChemAxon</source>
    </property>
  </predicted_properties>
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  <lethaldose/>
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  <use_source/>
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  <drugbank_id/>
  <hmdb_id/>
  <pubchem_compound_id>22397</pubchem_compound_id>
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