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1,2,3,4,4A,5,12,12A-OCTAHYDRO-1,4:5,12-DIMETHANO-6,11-DIMETHOXY-NAPHTHACENE-14-ONE
SpectraBase Compound ID In89YJ0mS7S
InChI InChI=1S/C22H22O3/c1-24-21-10-5-3-4-6-11(10)22(25-2)19-15-9-14(18(19)21)16-12-7-8-13(17(15)16)20(12)23/h3-6,12-17H,7-9H2,1-2H3/t12-,13+,14+,15-,16-,17+
InChIKey WCQCGFKVBFLDKF-BOFKIOBHSA-N
Mol Weight 334.42 g/mol
Molecular Formula C22H22O3
Exact Mass 334.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bw3AOocsUxW
Name 1,2,3,4,4A,5,12,12A-OCTAHYDRO-1,4:5,12-DIMETHANO-6,11-DIMETHOXY-NAPHTHACENE-14-ONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22O3
InChI InChI=1S/C22H22O3/c1-24-21-10-5-3-4-6-11(10)22(25-2)19-15-9-14(18(19)21)16-12-7-8-13(17(15)16)20(12)23/h3-6,12-17H,7-9H2,1-2H3/t12-,13+,14+,15-,16-,17+
InChIKey WCQCGFKVBFLDKF-BOFKIOBHSA-N
Literature Reference Author R.TOUILLAUX,J.L.H.JIWAN,J.P.SOUMILLION
Literature Reference Citation MAGN.RES.CHEM.,32,184(1994)
Literature Reference DOI 10.1002/mrc.1260320310
Molecular Weight 334.415 g/mol
Solvent CDCl3
Source File Reference UWCP1142