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2,2,5-TRIMETHYL-4-HEXEN-3-ONE

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2,2,5-TRIMETHYL-4-HEXEN-3-ONE
SpectraBase Compound ID K2QzHBSTfEp
InChI InChI=1S/C9H16O/c1-7(2)6-8(10)9(3,4)5/h6H,1-5H3
InChIKey OAGTWOAEPNSOJA-UHFFFAOYSA-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 KbpH0lND4tX
Name 2,2,5-TRIMETHYL-4-HEXEN-3-ONE
Compound Number 17A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H16O
InChI InChI=1S/C9H16O/c1-7(2)6-8(10)9(3,4)5/h6H,1-5H3
InChIKey OAGTWOAEPNSOJA-UHFFFAOYSA-N
Literature Reference Author A.S.VELLEKOOP,R.A.J.SMITH
Literature Reference Citation J.AM.CHEM.SOC.,116,2902(1994)
Literature Reference DOI 10.1021/ja00086a023
Molecular Weight 140.225 g/mol
Solvent CDCl3