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5-tert.-Butyl-3-methoxy-1-oxacyclohepta-3,5-diene-2,7-dione
SpectraBase Compound ID BDdeKueUDPs
InChI InChI=1S/C11H14O4/c1-11(2,3)7-5-8(14-4)10(13)15-9(12)6-7/h5-6H,1-4H3
InChIKey QIUMPEKPGIAFIG-UHFFFAOYSA-N
Mol Weight 210.23 g/mol
Molecular Formula C11H14O4
Exact Mass 210.089209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1iXmJkZabES
Name 5-tert.-Butyl-3-methoxy-1-oxacyclohepta-3,5-diene-2,7-dione
CAS Registry Number 72526-02-4
Comments broad-band decoupling (BB)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H14O4
InChI InChI=1S/C11H14O4/c1-11(2,3)7-5-8(14-4)10(13)15-9(12)6-7/h5-6H,1-4H3
InChIKey QIUMPEKPGIAFIG-UHFFFAOYSA-N
Instrument Name SF = 080 MHz
Literature Reference J. Org. Chem. 45, 1153 (1980).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3