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O7-(2-ACETOXYETHYL)-O1-METHYL-(3E)-HEPTENEDIOATE
SpectraBase Compound ID HUiX8zV9Pyu
InChI InChI=1S/C12H18O6/c1-10(13)17-8-9-18-12(15)7-5-3-4-6-11(14)16-2/h3-4H,5-9H2,1-2H3/b4-3+
InChIKey KJPXKASIUAZKML-ONEGZZNKSA-N
Mol Weight 258.27 g/mol
Molecular Formula C12H18O6
Exact Mass 258.110338 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JUTEeCNAUJr
Name O7-(2-ACETOXYETHYL)-O1-METHYL-(3E)-HEPTENEDIOATE
CAS Registry Number 127281-09-8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18O6
InChI InChI=1S/C12H18O6/c1-10(13)17-8-9-18-12(15)7-5-3-4-6-11(14)16-2/h3-4H,5-9H2,1-2H3/b4-3+
InChIKey KJPXKASIUAZKML-ONEGZZNKSA-N
Literature Reference Author U.GRUSECK,M.HEUSCHMANN
Literature Reference Citation CHEM.BER.,123,1911(1990)
Literature Reference DOI 10.1002/cber.19901230925
Molecular Weight 258.271 g/mol
Solvent CDCl3
Source File Reference UWED10425