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1H-AZEPIN-4,5-DIONE

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1H-AZEPIN-4,5-DIONE
SpectraBase Compound ID Ckv0esTttvr
InChI InChI=1S/C6H5NO2/c8-5-1-3-7-4-2-6(5)9/h1-4,7H
InChIKey XUECUUQDWZQZKG-UHFFFAOYSA-N
Mol Weight 123.11 g/mol
Molecular Formula C6H5NO2
Exact Mass 123.032028 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JTHghcPuWFv
Name 1H-AZEPIN-4,5-DIONE
Compound Number 5F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H5NO2
InChI InChI=1S/C6H5NO2/c8-5-1-3-7-4-2-6(5)9/h1-4,7H
InChIKey XUECUUQDWZQZKG-UHFFFAOYSA-N
Literature Reference Author H.G.BONACORSO,K.E.MACK,F.EFFENBERGER
Literature Reference Citation J.HETCYCL.CHEM.,32,57(1995)
Literature Reference DOI 10.1002/jhet.5570320110
Molecular Weight 123.111 g/mol
Solvent DMSO-D6
Source File Reference UWCS20699