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ISOCAPNELL-9-EN-8-ONE

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ISOCAPNELL-9-EN-8-ONE
SpectraBase Compound ID 8A0VXdoFrN4
InChI InChI=1S/C15H22O/c1-8-10-5-6-15(3,4)14(10)13-9(2)12(16)7-11(8)13/h8,10-11,14H,5-7H2,1-4H3/t8-,10-,11-,14-/m0/s1
InChIKey TXEVDRRVYILCKY-AEHQLWAISA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2K2PLa0hPbB
Name ISOCAPNELL-9-EN-8-ONE
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H22O
InChI InChI=1S/C15H22O/c1-8-10-5-6-15(3,4)14(10)13-9(2)12(16)7-11(8)13/h8,10-11,14H,5-7H2,1-4H3/t8-,10-,11-,14-/m0/s1
InChIKey TXEVDRRVYILCKY-AEHQLWAISA-N
Literature Reference Author A.R.D.VIVAR,D.A.NIETO,R.GAVINO,A.L.C.PEREZ
Literature Reference Citation PHYTOCHEM.,40,167(1995)
Literature Reference DOI 10.1016/0031-9422(95)00261-5
Molecular Weight 218.339 g/mol
Solvent CDCl3
Source File Reference UWVN3405