John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=DvJTH2id0jo SpectraBase Spectrum ID=1K9FntWd8Dz

(accessed ).
1-(3',4'-DIHYDROXYPHENYL)-ICOSAN-5-ONE
SpectraBase Compound ID DvJTH2id0jo
InChI InChI=1S/C26H44O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-24(27)19-16-15-17-23-20-21-25(28)26(29)22-23/h20-22,28-29H,2-19H2,1H3
InChIKey PLGBEKOEYNTIDJ-UHFFFAOYSA-N
Mol Weight 404.6 g/mol
Molecular Formula C26H44O3
Exact Mass 404.329046 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1K9FntWd8Dz
Name 1-(3',4'-DIHYDROXYPHENYL)-ICOSAN-5-ONE
Compound Number 3F
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H44O3
InChI InChI=1S/C26H44O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-24(27)19-16-15-17-23-20-21-25(28)26(29)22-23/h20-22,28-29H,2-19H2,1H3
InChIKey PLGBEKOEYNTIDJ-UHFFFAOYSA-N
Literature Reference Author C.BUERGI,G.LIU,P.RUEEDI
Literature Reference Citation HELV.CHIM.ACTA,76,1901(1993)
Molecular Weight 404.634 g/mol
Solvent CDCl3
Source File Reference UWRK695
SpectraBase Batch ID 15fHe47OEyQ