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2-[6-Fluoro-1-oxo-3-phenylisoquinolin-2(1H)-yl]-pyridine-1-oxide
SpectraBase Compound ID BS6FbcKpSJO
InChI InChI=1S/C20H13FN2O2/c21-16-9-10-17-15(12-16)13-18(14-6-2-1-3-7-14)23(20(17)24)19-8-4-5-11-22(19)25/h1-13H
InChIKey UBDVVLMZNPHHKC-UHFFFAOYSA-N
Mol Weight 332.33 g/mol
Molecular Formula C20H13FN2O2
Exact Mass 332.096106 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7CWRoWKs4hK
Name 2-[6-Fluoro-1-oxo-3-phenylisoquinolin-2(1H)-yl]-pyridine-1-oxide
Appearance White solid
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Formula C20H13FN2O2
InChI InChI=1S/C20H13FN2O2/c21-16-9-10-17-15(12-16)13-18(14-6-2-1-3-7-14)23(20(17)24)19-8-4-5-11-22(19)25/h1-13H
InChIKey UBDVVLMZNPHHKC-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/cssc.202000057
Molecular Weight 332.334 g/mol
Reported Formula C20H13FN2O2
SMILES c1cc2c(cc1F)C=C(N(C2=O)c1[n+](cccc1)[O-])c1ccccc1
SPLASH splash10-001i-5935000000-58cbe67b2ddc2844ebaf
Source of Spectrum CSC-13-SM12-3da
Wiley ID 1840060