Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-11-17 23:48:37 UTC
Update Date2024-04-30 19:43:43 UTC
Metabolite IDMMDBc0029964
Metabolite Identification
Common Name1-Nitronaphthalene-7,8-oxide
Description1-nitronaphthalene-7,8-oxide belongs to the class of Naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings. (inferred from compound structure)
Structure
SynonymsNot Available
Molecular FormulaC10H7NO3
Average Mass189.1675
Monoisotopic Mass189.042593095
IUPAC Name7-nitro-1aH,7bH-naphtho[1,2-b]oxirene
Traditional Name1-nitronaphthalene-7,8-oxide
CAS Registry NumberNot Available
SMILES
O=N(=O)C1=CC=CC2=C1C1OC1C=C2
InChI Identifier
InChI=1S/C10H7NO3/c12-11(13)7-3-1-2-6-4-5-8-10(14-8)9(6)7/h1-5,8,10H
InChI KeyJBECFHRNFSQXPM-UHFFFAOYSA-N