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2-METHYL-(4,4-DIMETHYL-3-OXOPENTYL)-1,3-CYCLOHEXANEDIONE
SpectraBase Compound ID LvRl9yl8aFK
InChI InChI=1S/C14H22O3/c1-13(2,3)10(15)8-9-14(4)11(16)6-5-7-12(14)17/h5-9H2,1-4H3
InChIKey WSZHQBVOUDJAJC-UHFFFAOYSA-N
Mol Weight 238.33 g/mol
Molecular Formula C14H22O3
Exact Mass 238.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1OriBC3l37z
Name 2-METHYL-(4,4-DIMETHYL-3-OXOPENTYL)-1,3-CYCLOHEXANEDIONE
CAS Registry Number 137518-36-6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H22O3
InChI InChI=1S/C14H22O3/c1-13(2,3)10(15)8-9-14(4)11(16)6-5-7-12(14)17/h5-9H2,1-4H3
InChIKey WSZHQBVOUDJAJC-UHFFFAOYSA-N
Literature Reference Author H.NAKAHIRA,I.RYU,M.IKEBE,Y.OKU,A.OGAWA,N.KAMBE,N.SONODA,S.MU RAI
Literature Reference Citation J.ORG.CHEM.,57,17(1992)
Literature Reference DOI 10.1021/jo00027a008
Molecular Weight 238.327 g/mol
Solvent CDCl3
Source File Reference UWCS2679