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1,8-DIHYDROXY-4-(4-METHYLBENZYL)-3-(4-METHYLPHENYL)-9H-XANTHEN-9-ONE
SpectraBase Compound ID 8gdyRyclgh2
InChI InChI=1S/C28H22O4/c1-16-6-10-18(11-7-16)14-21-20(19-12-8-17(2)9-13-19)15-23(30)26-27(31)25-22(29)4-3-5-24(25)32-28(21)26/h3-13,15,29-30H,14H2,1-2H3
InChIKey RKCNDJJXECRNGR-UHFFFAOYSA-N
Mol Weight 422.48 g/mol
Molecular Formula C28H22O4
Exact Mass 422.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FEoHytDg9kM
Name 1,8-DIHYDROXY-4-(4-METHYLBENZYL)-3-(4-METHYLPHENYL)-9H-XANTHEN-9-ONE
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H22O4
InChI InChI=1S/C28H22O4/c1-16-6-10-18(11-7-16)14-21-20(19-12-8-17(2)9-13-19)15-23(30)26-27(31)25-22(29)4-3-5-24(25)32-28(21)26/h3-13,15,29-30H,14H2,1-2H3
InChIKey RKCNDJJXECRNGR-UHFFFAOYSA-N
Literature Reference Author A.M.L.SECA,S.B.LEAL,D.C.G.A.PINTO,M.C.BARRETO,A.M.S.SILVA
Literature Reference Citation MOLECULES,19,8317(2014)
Literature Reference DOI 10.3390/molecules19068317
Molecular Weight 422.480 g/mol
Solvent CDCl3
Source File Reference UWIR14803