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3-[(1E)-buta-1,3-dienyl]-2,4,4-trimethylcyclohex-2-en-1-one

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3-[(1E)-buta-1,3-dienyl]-2,4,4-trimethylcyclohex-2-en-1-one
SpectraBase Compound ID 81BfKtDlvvY
InChI InChI=1S/C13H18O/c1-5-6-7-11-10(2)12(14)8-9-13(11,3)4/h5-7H,1,8-9H2,2-4H3/b7-6+
InChIKey NSFWSHKUSWODJO-VOTSOKGWSA-N
Mol Weight 190.29 g/mol
Molecular Formula C13H18O
Exact Mass 190.135765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AY3ayhFI6qa
Name 3-[(1E)-buta-1,3-dienyl]-2,4,4-trimethylcyclohex-2-en-1-one
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18O
InChI InChI=1S/C13H18O/c1-5-6-7-11-10(2)12(14)8-9-13(11,3)4/h5-7H,1,8-9H2,2-4H3/b7-6+
InChIKey NSFWSHKUSWODJO-VOTSOKGWSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 190.285 g/mol
Source File Reference MHKO2013