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2(R),3(S)-Diacetoxy-4-oxo-pentanal
SpectraBase Compound ID 2ejomTMpgUl
InChI InChI=1S/C9H12O6/c1-5(11)9(15-7(3)13)8(4-10)14-6(2)12/h4,8-9H,1-3H3
InChIKey XKOXERXSUKAGMG-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 Jy0afgwdmGK
Name 2(R),3(S)-Diacetoxy-4-oxo-pentanal
CAS Registry Number 114763-34-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H12O6
InChI InChI=1S/C9H12O6/c1-5(11)9(15-7(3)13)8(4-10)14-6(2)12/h4,8-9H,1-3H3
InChIKey XKOXERXSUKAGMG-UHFFFAOYSA-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