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cis-3,5-Dimethylcycloheptanone

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cis-3,5-Dimethylcycloheptanone
SpectraBase Compound ID EdeVyYiOAXv
InChI InChI=1S/C9H16O/c1-7-3-4-9(10)6-8(2)5-7/h7-8H,3-6H2,1-2H3/t7-,8-/m1/s1
InChIKey JBUWOYUMIPRSJF-HTQZYQBOSA-N
Mol Weight 140.23 g/mol
Molecular Formula C9H16O
Exact Mass 140.120115 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 60ESnyC6gsC
Name CIS-3,5-DIMETHYLCYCLOHEPTANONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H16O
InChI InChI=1S/C9H16O/c1-7-3-4-9(10)6-8(2)5-7/h7-8H,3-6H2,1-2H3/t7-,8-/m1/s1
InChIKey JBUWOYUMIPRSJF-HTQZYQBOSA-N
Literature Reference Author M.CHRISTL,J.D.ROBERTS
Literature Reference Citation J.ORG.CHEM.,37,3443(1972)
Literature Reference DOI 10.1021/jo00795a014
Molecular Weight 140.225 g/mol
Solvent DIOXANE
Source File Reference UNIW13975