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3-Benzoyl-5,5-dimethyl-tetronic acid
SpectraBase Compound ID 11wBoBtuWfH
InChI InChI=1S/C13H12O4/c1-13(2)11(15)9(12(16)17-13)10(14)8-6-4-3-5-7-8/h3-7,15H,1-2H3
InChIKey GGLRFDUUBWRGIO-UHFFFAOYSA-N
Mol Weight 232.23 g/mol
Molecular Formula C13H12O4
Exact Mass 232.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8RmFgJqi88Q
Name 3-Benzoyl-5,5-dimethyl-tetronic acid
CAS Registry Number 65193-40-0
Comments BETA-FORM
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H12O4
InChI InChI=1S/C13H12O4/c1-13(2)11(15)9(12(16)17-13)10(14)8-6-4-3-5-7-8/h3-7,15H,1-2H3
InChIKey GGLRFDUUBWRGIO-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference J.P. Jacobsen, T. Reffstrup, P.M.Boll, Acta Chem. Scand. B31, 756 (1977).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3