<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">361984</id>
  <title nil="true"/>
  <common-name>(ne)-n-(3,3-dimethyl-1-methylsulfanylbutan-2-ylidene)hydroxylamine</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>6518735</pubchem-id>
  <chemical-formula>C7H15NOS</chemical-formula>
  <weight>161.27</weight>
  <appearance nil="true"/>
  <melting-point nil="true"/>
  <boiling-point nil="true"/>
  <density nil="true"/>
  <solubility nil="true"/>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure nil="true"/>
  <target nil="true"/>
  <mechanism-of-toxicity nil="true"/>
  <metabolism nil="true"/>
  <toxicity nil="true"/>
  <lethaldose nil="true"/>
  <carcinogenicity nil="true"/>
  <use-source nil="true"/>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2026-09-01T11:02:41Z</created-at>
  <updated-at type="dateTime">2026-09-01T11:02:41Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id nil="true"/>
  <omim-id nil="true"/>
  <chebi-id nil="true"/>
  <biocyc-id nil="true"/>
  <ctd-id nil="true"/>
  <stitch-id nil="true"/>
  <drugbank-id nil="true"/>
  <pdb-id nil="true"/>
  <actor-id nil="true"/>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>CC(C)(C)C(=NO)CSC</moldb-smiles>
  <moldb-formula>C7H15NOS</moldb-formula>
  <moldb-inchi>InChI=1S/C7H15NOS/c1-7(2,3)6(8-9)5-10-4/h9H,5H2,1-4H3/b8-6-</moldb-inchi>
  <moldb-inchikey>WMNXDZQBHMQKLX-VURMDHGXSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
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  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.3</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
  <structure-image-file-name nil="true"/>
  <structure-image-content-type nil="true"/>
  <structure-image-file-size type="integer" nil="true"/>
  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM357877</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>(ne)-n-(3,3-dimethyl-1-methylsulfanylbutan-2-ylidene)hydroxylamine</iupac>
  <moldb-polar-surface-area nil="true"/>
  <moldb-refractivity nil="true"/>
  <moldb-polarizability nil="true"/>
  <moldb-rotatable-bond-count nil="true"/>
  <moldb-acceptor-count nil="true"/>
  <moldb-donor-count nil="true"/>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic nil="true"/>
  <moldb-physiological-charge nil="true"/>
  <moldb-number-of-rings nil="true"/>
  <moldb-alogps-logp nil="true"/>
  <moldb-alogps-logs nil="true"/>
  <moldb-alogps-solubility nil="true"/>
  <kingdom>Organic compounds</kingdom>
  <superklass>Organic nitrogen compounds</superklass>
  <klass>Organonitrogen compounds</klass>
  <subklass>Oximes</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0312082</sync-id>
  <structure-inchikey>WMNXDZQBHMQKLX-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>801000002800000000000000000000000000000000000002000000000000000001000000000000a00000000000000000000000000000000000000000000000000000000000000000000000000000000004040000000000000010010000000000000000000000000000000000000000000000000000000000000040000000010000000000000000000000000000000000000000000000000020008000000200000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000200010000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������
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  <structure-indexed-at type="dateTime">2026-09-19T05:59:10Z</structure-indexed-at>
</compound>
