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[R-(R*,S*)-(E,E)]-1-(5,6-DIHYDRO-5-OXO-2-H-PYRAN-2-YL)-2-METHYL-4,6-OCTADIEN-3-ONE
SpectraBase Compound ID 7sjM41OIPt7
InChI InChI=1S/C14H18O3/c1-3-4-5-6-14(16)11(2)9-13-8-7-12(15)10-17-13/h3-8,11,13H,9-10H2,1-2H3/b4-3+,6-5+/t11-,13+/m1/s1
InChIKey IAHJROQSGDNMBX-LLGCLBDTSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DDODBCJiXFH
Name [R-(R*,S*)-(E,E)]-1-(5,6-DIHYDRO-5-OXO-2-H-PYRAN-2-YL)-2-METHYL-4,6-OCTADIEN-3-ONE
Compound Number 5-B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-3-4-5-6-14(16)11(2)9-13-8-7-12(15)10-17-13/h3-8,11,13H,9-10H2,1-2H3/b4-3+,6-5+/t11-,13+/m1/s1
InChIKey IAHJROQSGDNMBX-LLGCLBDTSA-N
Literature Reference Author J.HERSCOVICI,S.DELATRE,L.BOUMAIZA,K.ANTONAKIS
Literature Reference Citation J.ORG.CHEM.,58,3928(1993)
Literature Reference DOI 10.1021/jo00067a027
Molecular Weight 234.295 g/mol
Solvent CDCl3
Source File Reference UWRU935