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4(S),5(S)-Diacetoxy-6-oxo-2-heptenal

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4(S),5(S)-Diacetoxy-6-oxo-2-heptenal
SpectraBase Compound ID Ai11xc1h5pu
InChI InChI=1S/C11H14O6/c1-7(13)11(17-9(3)15)10(5-4-6-12)16-8(2)14/h4-6,10-11H,1-3H3/b5-4+
InChIKey BDRYYBGJEKPWIN-SNAWJCMRSA-N
Mol Weight 242.23 g/mol
Molecular Formula C11H14O6
Exact Mass 242.079038 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CdgUkdQf4P5
Name 4(S),5(S)-Diacetoxy-6-oxo-2-heptenal
CAS Registry Number 114763-37-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H14O6
InChI InChI=1S/C11H14O6/c1-7(13)11(17-9(3)15)10(5-4-6-12)16-8(2)14/h4-6,10-11H,1-3H3/b5-4+
InChIKey BDRYYBGJEKPWIN-SNAWJCMRSA-N
Literature Reference T. Hudlicky, H. Luna, G. Barbieri, J. Am. Chem. Soc. 110, 4735 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3