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2,4,5-Trimethyl-2-hydroperoxy-5-hexen-3-one

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2,4,5-Trimethyl-2-hydroperoxy-5-hexen-3-one
SpectraBase Compound ID GfKI0Hyxf49
InChI InChI=1S/C9H16O3/c1-6(2)7(3)8(10)9(4,5)12-11/h7,11H,1H2,2-5H3
InChIKey VJBNZMVGASWSBR-UHFFFAOYSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FQut1C3mgiw
Name 2,4,5-Trimethyl-2-hydroperoxy-5-hexen-3-one
CAS Registry Number 65599-19-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-6(2)7(3)8(10)9(4,5)12-11/h7,11H,1H2,2-5H3
InChIKey VJBNZMVGASWSBR-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference L.K. Sydnes, Acta Chem. Scand. B31, 903 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4