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3-(BUT-3-ENYL)-4-METHYLTROPONE;3-(BUT-3-ENYL)-4-METHYL-CYCLOHEPTA-2,4,6-TRIENONE
SpectraBase Compound ID EwSctJiHeEa
InChI InChI=1S/C12H14O/c1-3-4-7-11-9-12(13)8-5-6-10(11)2/h3,5-6,8-9H,1,4,7H2,2H3
InChIKey RCQPLYIBBOMMDO-UHFFFAOYSA-N
Mol Weight 174.24 g/mol
Molecular Formula C12H14O
Exact Mass 174.104465 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6B8xri0bRMF
Name 3-(BUT-3-ENYL)-4-METHYLTROPONE;3-(BUT-3-ENYL)-4-METHYL-CYCLOHEPTA-2,4,6-TRIENONE
Compound Number 5G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14O
InChI InChI=1S/C12H14O/c1-3-4-7-11-9-12(13)8-5-6-10(11)2/h3,5-6,8-9H,1,4,7H2,2H3
InChIKey RCQPLYIBBOMMDO-UHFFFAOYSA-N
Literature Reference Author S.SENDELBACH,R.SCHWETZLER-RASCHKE,A.RADL,R.KAISER,G.H.HENLE, H.KORFANT,S.REINER,B
Literature Reference Citation J.ORG.CHEM.,64,3398(1999)
Literature Reference DOI 10.1021/jo972037g
Molecular Weight 174.243 g/mol
Sample ID 39771
Solvent CDCl3