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3-(2'-METHYLPENTYL)-5-METHYL-2-OCTANONE (DIASTEREOMER MIXTURE)
SpectraBase Compound ID GjMTGGw39wI
InChI InChI=1S/C15H30O/c1-6-8-12(3)10-15(14(5)16)11-13(4)9-7-2/h12-13,15H,6-11H2,1-5H3
InChIKey FTJDTKFASKBURS-UHFFFAOYSA-N
Mol Weight 226.4 g/mol
Molecular Formula C15H30O
Exact Mass 226.229666 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4nxsgxcbDiP
Name 3-(2'-METHYLPENTYL)-5-METHYL-2-OCTANONE (DIASTEREOMER MIXTURE)
Comments S=
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H30O
InChI InChI=1S/C15H30O/c1-6-8-12(3)10-15(14(5)16)11-13(4)9-7-2/h12-13,15H,6-11H2,1-5H3
InChIKey FTJDTKFASKBURS-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference N.P.TARASOVA, A.G.SHOSTENKO, YU.M.LUGOVOI, YU.V.SMETANNIKOV (1979)Zhurn.Org.Khim.(Russ. Lang.): v.15, N11, 2241-2245.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d