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METHYLMALONIC ACID, CYCLIC alpha-METHYLBENZYLIDENE ESTER
SpectraBase Compound ID 147W1j14E01
InChI InChI=1S/C12H12O4/c1-8-10(13)15-12(2,16-11(8)14)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKey MXCQWJPGZJIVSB-UHFFFAOYSA-N
Mol Weight 220.22 g/mol
Molecular Formula C12H12O4
Exact Mass 220.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K07mcuEG45t
Name 2,5-Dimethyl-2-phenyl-4,6-dioxo-1,3-dioxane
CAS Registry Number 62255-31-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H12O4
InChI InChI=1S/C12H12O4/c1-8-10(13)15-12(2,16-11(8)14)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKey MXCQWJPGZJIVSB-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference P. Ayras, Acta Chem. Scand. B30, 957 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Acetone-D6