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1,3-Di-tert-butyl-7-oxa-cyclohepta-1,3-dien-5,6-dione

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1,3-Di-tert-butyl-7-oxa-cyclohepta-1,3-dien-5,6-dione
SpectraBase Compound ID IK5Y0Rmkr3E
InChI InChI=1S/C14H20O3/c1-13(2,3)9-7-10(15)12(16)17-11(8-9)14(4,5)6/h7-8H,1-6H3
InChIKey HZXOAQYNLHHLQP-UHFFFAOYSA-N
Mol Weight 236.31 g/mol
Molecular Formula C14H20O3
Exact Mass 236.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KE7SQ54B754
Name 1,3-Di-tert-butyl-7-oxa-cyclohepta-1,3-dien-5,6-dione
CAS Registry Number 80631-09-0
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H20O3
InChI InChI=1S/C14H20O3/c1-13(2,3)9-7-10(15)12(16)17-11(8-9)14(4,5)6/h7-8H,1-6H3
InChIKey HZXOAQYNLHHLQP-UHFFFAOYSA-N
Literature Reference M. Matsumoto, K. Kuroda, J. Am. Chem. Soc. 104, 1433 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD2Cl2