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CHEBI:183734 - 6-methyl-7-nitro-2,3-dihydro-1,4-benzodioxine

ChEBI IDCHEBI:183734
ChEBI Name6-methyl-7-nitro-2,3-dihydro-1,4-benzodioxine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H9NO4
Net Charge0
Average Mass195.174
Monoisotopic Mass195.05316
SMILESCc1cc2c(cc1[N+](=O)[O-])OCCO2
InChIInChI=1S/C9H9NO4/c1-6-4-8-9(14-3-2-13-8)5-7(6)10(11)12/h4-5H,2-3H2,1H3
InChIKeyIOIVECGQHFGMMC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bombus terrestris (ncbitaxon:30195)
hemolymph (BTO:0000572) MetaboLights (MTBLS3637)
brain (BTO:0000142) MetaboLights (MTBLS3637)
hindgut (BTO:0000510) MetaboLights (MTBLS3637)
ChEBI Ontology
Outgoing Relation(s)
6-methyl-7-nitro-2,3-dihydro-1,4-benzodioxine (CHEBI:183734) is a benzodioxine (CHEBI:64096)
IUPAC Name 
7-methyl-6-nitro-2,3-dihydro-1,4-benzodioxine
Manual XrefsDatabases
39263ChemSpider
Registry NumbersSources
CAS:59820-83-6ChemIDplus