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(3S,5S)-3-ALLYL-5-CARBOXY-3-METHYLTETRAHYDROFURAN-2-ONE
SpectraBase Compound ID JlsUiWQUClx
InChI InChI=1S/C9H12O4/c1-3-4-9(2)5-6(7(10)11)13-8(9)12/h3,6H,1,4-5H2,2H3,(H,10,11)
InChIKey JREFBXCTMSYIFA-UHFFFAOYSA-N
Mol Weight 184.19 g/mol
Molecular Formula C9H12O4
Exact Mass 184.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KjERg3UD62e
Name (3S,5S)-3-ALLYL-5-CARBOXY-3-METHYLTETRAHYDROFURAN-2-ONE
Compound Number 26
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12O4
InChI InChI=1S/C9H12O4/c1-3-4-9(2)5-6(7(10)11)13-8(9)12/h3,6H,1,4-5H2,2H3,(H,10,11)
InChIKey JREFBXCTMSYIFA-UHFFFAOYSA-N
Literature Reference Author R.L.MACKMAN,J.MICKLEFIELD,M.H.BLOCK,F.J.LEEPER,A.R.BATTERSBY
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2111(1997)
Literature Reference DOI 10.1039/a700654c
Molecular Weight 184.192 g/mol
Solvent CDCl3
Source File Reference UWRU3706