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Methyl 5-Oxo-3-[(Z)-1-propenyl]octanoate
SpectraBase Compound ID ci44gC6aib
InChI InChI=1S/C12H20O3/c1-4-6-10(9-12(14)15-3)8-11(13)7-5-2/h4,6,10H,5,7-9H2,1-3H3/b6-4-
InChIKey QUIZOTGZJYSFOF-XQRVVYSFSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C3NOmLqm3cX
Name METHYL-5-OXO-3-[(Z)-1-PROPENYL]-OCTANOATE
Compound Number 8 A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-4-6-10(9-12(14)15-3)8-11(13)7-5-2/h4,6,10H,5,7-9H2,1-3H3/b6-4-
InChIKey QUIZOTGZJYSFOF-XQRVVYSFSA-N
Literature Reference Author J.POLDY,R.PEAKALL,R.A.BARROW
Literature Reference Citation EUR.J.ORG.CHEM.,2012,5818(2012)
Literature Reference DOI 10.1002/ejoc.201200795
Molecular Weight 212.289 g/mol
Solvent CDCl3
Source File Reference UWLU83883