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9-(2'-ACETOXYPHENYL)-3,3,6,6-TETRAMETHYL-1,2,3,4,5,6,7,8-OCTAHYDRO-9-H-XANTHEN-1,8-DIONE
SpectraBase Compound ID 1txCS2HvE4z
InChI InChI=1S/C25H28O5/c1-14(26)29-18-9-7-6-8-15(18)21-22-16(27)10-24(2,3)12-19(22)30-20-13-25(4,5)11-17(28)23(20)21/h6-9,21H,10-13H2,1-5H3
InChIKey BXGHQZSUCAQRBW-UHFFFAOYSA-N
Mol Weight 408.49 g/mol
Molecular Formula C25H28O5
Exact Mass 408.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ADm3WdH451v
Name 9-(2'-ACETOXYPHENYL)-3,3,6,6-TETRAMETHYL-1,2,3,4,5,6,7,8-OCTAHYDRO-9-H-XANTHEN-1,8-DIONE
Compound Number IX
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28O5
InChI InChI=1S/C25H28O5/c1-14(26)29-18-9-7-6-8-15(18)21-22-16(27)10-24(2,3)12-19(22)30-20-13-25(4,5)11-17(28)23(20)21/h6-9,21H,10-13H2,1-5H3
InChIKey BXGHQZSUCAQRBW-UHFFFAOYSA-N
Literature Reference Author A.N.PYRKO
Literature Reference Citation CHEM.HET.COMP.,32,635(1996)
Literature Reference DOI 10.1007/bf01164861
Molecular Weight 408.494 g/mol
Solvent CDCl3
Source File Reference UWMZ13868