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Cyclooctane-1,4-dione mono(ethylene acetal)
SpectraBase Compound ID B0lgpR5cVkz
InChI InChI=1S/C10H16O3/c11-9-3-1-2-5-10(6-4-9)12-7-8-13-10/h1-8H2
InChIKey ZFBWZHOFZRCWFC-UHFFFAOYSA-N
Mol Weight 184.23 g/mol
Molecular Formula C10H16O3
Exact Mass 184.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ix8rllDvr1K
Name Cyclooctane-1,4-dione mono(ethylene acetal)
CAS Registry Number 66528-99-2
Comments SHIFT OF 176.17 PPM REPORTED FOR C4 MUST BE IN ERROR (FOLDED ?)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H16O3
InChI InChI=1S/C10H16O3/c11-9-3-1-2-5-10(6-4-9)12-7-8-13-10/h1-8H2
InChIKey ZFBWZHOFZRCWFC-UHFFFAOYSA-N
Literature Reference P.A. Chaloner, A.B. Holmes, M.A. McKervey, J. Chem. Soc. Perkin I 2524 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3