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3-METHYLHEPT-6-EN-2-ONE

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3-METHYLHEPT-6-EN-2-ONE
SpectraBase Compound ID DlHVQoXsA9w
InChI InChI=1S/C8H14O/c1-4-5-6-7(2)8(3)9/h4,7H,1,5-6H2,2-3H3
InChIKey NYOPIVRWCXPDSF-UHFFFAOYSA-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 CJncxFq6Us2
Name 3-METHYLHEPT-6-EN-2-ONE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H14O
InChI InChI=1S/C8H14O/c1-4-5-6-7(2)8(3)9/h4,7H,1,5-6H2,2-3H3
InChIKey NYOPIVRWCXPDSF-UHFFFAOYSA-N
Literature Reference Author K.E.BAILEY,B.R.DAVIS
Literature Reference Citation AUSTR.J.CHEM.,48,1827(1995)
Literature Reference DOI 10.1071/ch9951827
Molecular Weight 126.199 g/mol
Solvent CDCl3
Source File Reference UWCP287