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2-[2-(2-fluoro-4,5-dihydroxy-phenyl)-2-keto-ethyl]isoindoline-1,3-quinone
SpectraBase Compound ID L0qY6Wk2etz
InChI InChI=1S/C16H10FNO5/c17-11-6-13(20)12(19)5-10(11)14(21)7-18-15(22)8-3-1-2-4-9(8)16(18)23/h1-6,19-20H,7H2
InChIKey IPHMODBWOSSMCE-UHFFFAOYSA-N
Mol Weight 315.26 g/mol
Molecular Formula C16H10FNO5
Exact Mass 315.054301 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BTiJdkWFte4
Compound Number 23
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C16H10FNO5/c17-11-6-13(20)12(19)5-10(11)14(21)7-18-15(22)8-3-1-2-4-9(8)16(18)23/h1-6,19-20H,7H2
InChIKey IPHMODBWOSSMCE-UHFFFAOYSA-N
Literature Reference H.B.STEGMANN,G.DEUSCHLE,P.SCHULER J.CHEM.SOC.PERKIN-2,547(1994)
Solvent Dimethyl sulfoxide-d6