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METHYL-(2E,6Z)-12-OXODODECA-2,6-DIENOATE

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METHYL-(2E,6Z)-12-OXODODECA-2,6-DIENOATE
SpectraBase Compound ID B9zcPMmdok5
InChI InChI=1S/C13H20O3/c1-16-13(15)11-9-7-5-3-2-4-6-8-10-12-14/h2-3,9,11-12H,4-8,10H2,1H3/b3-2-,11-9+
InChIKey MNRXOCHNJHFERQ-OFKCTWATSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hqx6vtTBt4x
Name METHYL-(2E,6Z)-12-OXO-DODECA-2,6-DIENOATE
Compound Number 1 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-16-13(15)11-9-7-5-3-2-4-6-8-10-12-14/h2-3,9,11-12H,4-8,10H2,1H3/b3-2-,11-9+
InChIKey MNRXOCHNJHFERQ-OFKCTWATSA-N
Literature Reference Author S.E.DENMARK,L.GOMEZ
Literature Reference Citation J.ORG.CHEM.,68,8015(2003)
Literature Reference DOI 10.1021/jo034853w
Molecular Weight 224.300 g/mol
Solvent CDCl3
Source File Reference UWVN20742