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trans-2,5-DIMETHYLCYCLOHEXANONE

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trans-2,5-DIMETHYLCYCLOHEXANONE
SpectraBase Compound ID FM8z1wIowaa
InChI InChI=1S/C8H14O/c1-6-3-4-7(2)8(9)5-6/h6-7H,3-5H2,1-2H3/t6-,7-/s2
InChIKey LUGFNAYTNQMMMY-WZTWBHKBSA-N
Mol Weight 126.2 g/mol
Molecular Formula C8H14O
Exact Mass 126.104465 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7rv7SHRnzDs
Name trans-2,5-DIMETHYLCYCLOHEXANONE
Source of Sample J. B. Stothers, C. T. Tan Can. J. Chem. 52, 308(1974)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O
InChI InChI=1S/C8H14O/c1-6-3-4-7(2)8(9)5-6/h6-7H,3-5H2,1-2H3/t6-,7-/s2
InChIKey LUGFNAYTNQMMMY-WZTWBHKBSA-N
Molecular Weight 126.20
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Varian XL-100
Synonyms CYCLOHEXANONE, 2,5-DIMETHYL-, trans-,