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METHYL_4,5-EPOXY-5-[3',4'-METHYLENEDIOXYPHENYL]-PENT-2-ENOATE;ISOMER_A
SpectraBase Compound ID JIVcDjpbxW1
InChI InChI=1S/C13H12O5/c1-15-12(14)5-4-10-13(18-10)8-2-3-9-11(6-8)17-7-16-9/h2-6,10,13H,7H2,1H3/b5-4+
InChIKey VCFIGQWMMSHESX-SNAWJCMRSA-N
Mol Weight 248.23 g/mol
Molecular Formula C13H12O5
Exact Mass 248.068473 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7NqQoGzddUp
Name METHYL_4,5-EPOXY-5-[3',4'-METHYLENEDIOXYPHENYL]-PENT-2-ENOATE;ISOMER_B
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H12O5
InChI InChI=1S/C13H12O5/c1-15-12(14)5-4-10-13(18-10)8-2-3-9-11(6-8)17-7-16-9/h2-6,10,13H,7H2,1H3/b5-4+
InChIKey VCFIGQWMMSHESX-SNAWJCMRSA-N
Literature Reference Author D.J.ALDOUS,A.J.DALENCON,P.G.STEEL
Literature Reference Citation ORG.LETTERS,4,1159(2002)
Literature Reference DOI 10.1021/ol025569e
Molecular Weight 248.235 g/mol
Solvent Unknown
Source File Reference UWMZ25664