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3-ACETYL-6-METHYL-2-OXO-2H-PYRAN-5-CARBOXYLIC ACID, METHYL ESTER
SpectraBase Compound ID J52PY5BngoD
InChI InChI=1S/C10H10O5/c1-5(11)7-4-8(9(12)14-3)6(2)15-10(7)13/h4H,1-3H3
InChIKey OXAHRJDLGIWUED-UHFFFAOYSA-N
Mol Weight 210.18 g/mol
Molecular Formula C10H10O5
Exact Mass 210.052823 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2nvjJjxxmle
Name 3-Acetyl-5-methoxycarbonyl-6-methyl-2-pyrone
CAS Registry Number 6853-77-6
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H10O5
InChI InChI=1S/C10H10O5/c1-5(11)7-4-8(9(12)14-3)6(2)15-10(7)13/h4H,1-3H3
InChIKey OXAHRJDLGIWUED-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference S.A. Baker, M.J. Begley, L. Crombie, J. Chem. Soc. Perkin I 182 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3