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1-[4-[2,4,5-TRI-(4-ACETYLPHENOXYMETHYL)-BEZYLOXY]-PHENYL]-1-ETHANONE
SpectraBase Compound ID 79p6ijalFIP
InChI InChI=1S/C42H38O8/c1-27(43)31-5-13-39(14-6-31)47-23-35-21-37(25-49-41-17-9-33(10-18-41)29(3)45)38(26-50-42-19-11-34(12-20-42)30(4)46)22-36(35)24-48-40-15-7-32(8-16-40)28(2)44/h5-22H,23-26H2,1-4H3
InChIKey RLGUUEJQESYNLY-UHFFFAOYSA-N
Mol Weight 670.8 g/mol
Molecular Formula C42H38O8
Exact Mass 670.256668 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5OzkKlPiIgj
Name 1-[4-[2,4,5-TRI-(4-ACETYLPHENOXYMETHYL)-BEZYLOXY]-PHENYL]-1-ETHANONE
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H38O8
InChI InChI=1S/C42H38O8/c1-27(43)31-5-13-39(14-6-31)47-23-35-21-37(25-49-41-17-9-33(10-18-41)29(3)45)38(26-50-42-19-11-34(12-20-42)30(4)46)22-36(35)24-48-40-15-7-32(8-16-40)28(2)44/h5-22H,23-26H2,1-4H3
InChIKey RLGUUEJQESYNLY-UHFFFAOYSA-N
Literature Reference Author M.AL-SMADI,S.RATROUT
Literature Reference Citation J.HETCYCL.CHEM.,41,887(2004)
Literature Reference DOI 10.1002/jhet.5570410607
Molecular Weight 670.759 g/mol
Solvent CDCl3
Source File Reference UWLU22509