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5,5-dimethyl-1,3-cyclohexandione
SpectraBase Compound ID GrAQaIUixl1
InChI InChI=1S/C8H12O2/c1-8(2)4-6(9)3-7(10)5-8/h3,9H,4-5H2,1-2H3
InChIKey PQZVNKWTNLBLHJ-UHFFFAOYSA-N
Mol Weight 140.18 g/mol
Molecular Formula C8H12O2
Exact Mass 140.08373 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2m848yIKG10
Name 5,5-DIMETHYL-1,3-CYCLOHEXANEDIONE;DIMEDONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H12O2
InChI InChI=1S/C8H12O2/c1-8(2)4-6(9)3-7(10)5-8/h3,9H,4-5H2,1-2H3
InChIKey PQZVNKWTNLBLHJ-UHFFFAOYSA-N
Literature Reference Author F.IMASHIRO,S.MAEDA,K.TAKEGOSHI,T.TERAO,A.SAIKA
Literature Reference Citation CHEM.PHYS.LETT.,92,642(1982)
Literature Reference DOI 10.1016/0009-2614(82)83665-8
Molecular Weight 140.182 g/mol
Solvent DMSO-D6
Source File Reference UWCS9791