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1,5,9-Trioxo-2,6,10-trioxa-cyclododecane
SpectraBase Compound ID DAVQVEuq0Dp
InChI InChI=1S/C9H12O6/c10-7-1-4-13-8(11)3-6-15-9(12)2-5-14-7/h1-6H2
InChIKey CTKHYBXLKVJXEN-UHFFFAOYSA-N
Mol Weight 216.19 g/mol
Molecular Formula C9H12O6
Exact Mass 216.063388 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DRNobPZ67of
Name 1,5,9-Trioxo-2,6,10-trioxa-cyclododecane
CAS Registry Number 80109-29-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H12O6
InChI InChI=1S/C9H12O6/c10-7-1-4-13-8(11)3-6-15-9(12)2-5-14-7/h1-6H2
InChIKey CTKHYBXLKVJXEN-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference A. Shanzer, J. Libman, S. Lifson, J. Am. Chem. Soc. 108, 7609 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3