Dataset

Fluoromethacin; LC-ESI-Q; MS; POS; 45 V

This MassBank record with Accession MSBNK-Waters-WA001372 contains the MS mass spectrum of Fluoromethacin with the InChIkey NSNZBVZOKLXXFU-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C19H16FNO4/c1-11-18(19(24)12-3-5-13(20)6-4-12)15-8-7-14(25-2)9-16(15)21(11)10-17(22)23/h3-9H,10H2,1-2H3,(H,22,23)
SMILES COc(c3)cc(n(CC(O)=O)1)c(c3)c(C(=O)c(c2)ccc(F)c2)c(C)1
InChI Key NSNZBVZOKLXXFU-UHFFFAOYSA-N
Molecular Formula C19H16FNO4
Exact Mass 341.106 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA001372
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • 2-[3-(4-fluorobenzoyl)-6-methoxy-2-methylindol-1-yl]acetic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    J36.993D Nikkaji
    DTXSID50180462 EPA CompTox Dashboard
    33177 PubChem
    25803-21-8 ACToR
    The data in this table is sourced from UniChem at EBI.