CHEBI:34069 - 1,8-Dinitropyrene

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ChEBI Name 1,8-Dinitropyrene
ChEBI ID CHEBI:34069
Stars This entity has been manually annotated by a third party.
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Formula C16H8N2O4
Net Charge 0
Average Mass 292.246
Monoisotopic Mass 292.04841
InChI InChI=1S/C16H8N2O4/c19-17(20)13-7-3-9-1-2-10-4-8-14(18(21)22)12-6-5-11(13)15(9)16(10)12/h1-8H
InChIKey BLYXNIHKOMELAP-UHFFFAOYSA-N
SMILES [O-][N+](=O)c1ccc2ccc3ccc([N+]([O-])=O)c4ccc1c2c34
ChEBI Ontology
Outgoing 1,8-Dinitropyrene (CHEBI:34069) is a pyrenes (CHEBI:59659)
Synonym Source
1,8-Dinitropyrene KEGG COMPOUND
Manual Xref Database
C14423 KEGG COMPOUND
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Registry Number Type Source
42397-65-9 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014