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(3RS)-METHYL-(4E)-3-HYDROXY-2-METHYL-4-HEXENOATE,ISOMER-#1
SpectraBase Compound ID ICMgdJiNLqx
InChI InChI=1S/C8H14O3/c1-4-5-7(9)6(2)8(10)11-3/h4-7,9H,1-3H3/b5-4+
InChIKey JEHGEKPSUMDBCP-SNAWJCMRSA-N
Mol Weight 158.2 g/mol
Molecular Formula C8H14O3
Exact Mass 158.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8D5g9UffdNr
Name (3RS)-METHYL-(4E)-3-HYDROXY-2-METHYL-4-HEXENOATE,ISOMER-#2
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H14O3
InChI InChI=1S/C8H14O3/c1-4-5-7(9)6(2)8(10)11-3/h4-7,9H,1-3H3/b5-4+
InChIKey JEHGEKPSUMDBCP-SNAWJCMRSA-N
Literature Reference Author M.CERONI,U.SEQUIN
Literature Reference Citation HELV.CHIM.ACTA,65,302(1982)
Literature Reference DOI 10.1002/hlca.19820650133
Molecular Weight 158.197 g/mol
Solvent CDCl3
Source File Reference UWCS9882