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2-Ethyl-5-[(E)-1-propenyl]-1,3-cyclohexanedione
SpectraBase Compound ID 6JIv8wrrQdg
InChI InChI=1S/C11H16O2/c1-3-5-8-6-10(12)9(4-2)11(13)7-8/h3,5,8-9H,4,6-7H2,1-2H3/b5-3+
InChIKey XBRPRUBSWOYEBI-HWKANZROSA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FpZIwQAfTd3
Name 2-ETHYL-5-[(E)-1-PROPENYL]-1,3-CYCLOHEXANEDIONE
Compound Number 1H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-3-5-8-6-10(12)9(4-2)11(13)7-8/h3,5,8-9H,4,6-7H2,1-2H3/b5-3+
InChIKey XBRPRUBSWOYEBI-HWKANZROSA-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 180.247 g/mol
Solvent CD3OD
Source File Reference UWLU83903