Dataset

5-Hydroxyflunixin

This MassBank record with Accession MSBNK-Athens_Univ-AU115705 contains the MS2 mass spectrum of 5-Hydroxyflunixin with the InChIkey JSXNJGKWSWRIGA-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C14H11F3N2O3/c1-7-10(14(15,16)17)3-2-4-11(7)19-12-9(13(21)22)5-8(20)6-18-12/h2-6,20H,1H3,(H,18,19)(H,21,22)
SMILES Cc1c(cccc1Nc2c(cc(cn2)O)C(=O)O)C(F)(F)F
InChI Key JSXNJGKWSWRIGA-UHFFFAOYSA-N
Molecular Formula C14H11F3N2O3
Exact Mass 312.072 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU115705
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:46:32.580393
MetadataModified 2024-01-11T09:46:32.739259
MetadataPublished 2015-09-23
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
12978215 PubChem
DTXSID60514274 EPA CompTox Dashboard
ZINC000022060677 ZINC
25037492 eMolecules
PD150652 ProbesDrugs
HMDB0246804 Human Metabolome Database
J1.152.127D Nikkaji
The data in this table is sourced from UniChem at EBI.