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(2E)-3-Methyl-6-oxo-2-hexenyl acetate
SpectraBase Compound ID 7PEDyHi9Vgr
InChI InChI=1S/C9H14O3/c1-8(4-3-6-10)5-7-12-9(2)11/h5-6H,3-4,7H2,1-2H3/b8-5+
InChIKey RGAIVGKJOJFCTG-VMPITWQZSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2bxUCRxWAYG
Name 6-Acetoxy-4-methyl-trans-4-hexenal
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-8(4-3-6-10)5-7-12-9(2)11/h5-6H,3-4,7H2,1-2H3/b8-5+
InChIKey RGAIVGKJOJFCTG-VMPITWQZSA-N
Literature Reference J.E. McMurry, M.D. Erion, J. Am. Chem. Soc. 107, 2712 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3