CHEBI:80927 - 3,5-Dinitroguaiacol

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ChEBI Name 3,5-Dinitroguaiacol ChEBI ID CHEBI:80927 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C7H6N2O6 Net Charge 0 Average Mass 214.13230 Monoisotopic Mass 214.02259 InChI InChI=1S/C7H6N2O6/c1-15-7-5(9(13)14)2-4(8(11)12)3-6(7)10/h2-3,10H,1H3 InChIKey BWXKGZVAOLOFJU-UHFFFAOYSA-N SMILES COc1c(O)cc(cc1[N+]([O-])=O)[N+]([O-])=O ChEBI Ontology Outgoing 3,5-Dinitroguaiacol (CHEBI:80927) is a C-nitro compound (CHEBI:35716) 3,5-Dinitroguaiacol (CHEBI:80927) is a phenols (CHEBI:33853) Manual Xref Database C17101 KEGG COMPOUND View more database links Registry Number Type Source 63975-57-5 CAS Registry Number KEGG COMPOUND