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5-Methyl-1,3-cyclohexanedione
SpectraBase Compound ID I62IZ3zUv09
InChI InChI=1S/C7H10O2/c1-5-2-6(8)4-7(9)3-5/h5H,2-4H2,1H3
InChIKey DMIIMPQQPXUKOO-UHFFFAOYSA-N
Mol Weight 126.15 g/mol
Molecular Formula C7H10O2
Exact Mass 126.06808 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3KyhAZTBQyo
Name 5-METHYL-1,3-CYCLOHEXANEDIONE
CAS Registry Number 4341-24-6
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H10O2
InChI InChI=1S/C7H10O2/c1-5-2-6(8)4-7(9)3-5/h5H,2-4H2,1H3
InChIKey DMIIMPQQPXUKOO-UHFFFAOYSA-N
Literature Reference Author A.K.MUSSER,P.L.FUCHS
Literature Reference Citation J.ORG.CHEM.,47,3121(1982)
Literature Reference DOI 10.1021/jo00137a018
Molecular Weight 126.155 g/mol
Solvent CDCl3
Source File Reference UWCS11329