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ONTOLOGY REPORT - ANNOTATIONS


Term:buta-1,2-diene
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Accession:CHEBI:39480 term browser browse the term
Definition:A butadiene that has formula C4H6.
Synonyms:related_synonym: 1,2-Butadien;   1,2-butadiene;   1-methylallene;   Buta-1,2-dien;   CH2=C=CH-CH3;   Formula=C4H6;   InChI=1S/C4H6/c1-3-4-2/h4H,1H2,2H3;   InChIKey=QNRMTGGDHLBXQZ-UHFFFAOYSA-N;   SMILES=CC=C=C;   methylallene
 xref: Beilstein:1730808 "Beilstein";   CAS:590-19-2 "ChemIDplus";   CAS:590-19-2 "NIST Chemistry WebBook";   Gmelin:1144 "Gmelin"


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  CHEBI ontology 19754
    chemical entity 19753
      atom 19752
        nonmetal atom 19624
          carbon atom 19517
            organic molecular entity 19517
              olefinic compound 14447
                allenes 28
                  buta-1,2-diene 0
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  CHEBI ontology 19754
    subatomic particle 19752
      composite particle 19752
        hadron 19752
          baryon 19752
            nucleon 19752
              atomic nucleus 19752
                atom 19752
                  main group element atom 19637
                    main group molecular entity 19637
                      s-block molecular entity 19397
                        hydrogen molecular entity 19386
                          hydrides 18356
                            organic hydride 17693
                              organic fundamental parent 17693
                                hydrocarbon 17168
                                  olefin 7163
                                    acyclic olefin 7143
                                      alkadiene 2068
                                        butadiene 2061
                                          buta-1,2-diene 0
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