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SELAGINELLIN-O;4-[[4'-HYDROXY-4-FORMYL-3-[(4-HYDROXYPHENYL)-ETHYNYL]-BIPHENYL-2-YL]-(4-HYDROXYPHENYL)-METHYLENE]-CYCLO-HEXA-2,5-DIEN-1-ONE

View entire compound with spectra: 1 NMR

SELAGINELLIN-O;4-[[4'-HYDROXY-4-FORMYL-3-[(4-HYDROXYPHENYL)-ETHYNYL]-BIPHENYL-2-YL]-(4-HYDROXYPHENYL)-METHYLENE]-CYCLO-HEXA-2,5-DIEN-1-ONE
SpectraBase Compound ID 23Garbt3P2w
InChI InChI=1S/C34H22O5/c35-21-26-10-20-31(23-4-13-28(37)14-5-23)34(32(26)19-3-22-1-11-27(36)12-2-22)33(24-6-15-29(38)16-7-24)25-8-17-30(39)18-9-25/h1-2,4-18,20-21,36-38H
InChIKey DGNDPPRQBPGDSU-UHFFFAOYSA-N
Mol Weight 510.5 g/mol
Molecular Formula C34H22O5
Exact Mass 510.146724 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AqbbaVZgBRN
Name SELAGINELLIN-O;4-[[4'-HYDROXY-4-FORMYL-3-[(4-HYDROXYPHENYL)-ETHYNYL]-BIPHENYL-2-YL]-(4-HYDROXYPHENYL)-METHYLENE]-CYCLO-HEXA-2,5-DIEN-1-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H22O5
InChI InChI=1S/C34H22O5/c35-21-26-10-20-31(23-4-13-28(37)14-5-23)34(32(26)19-3-22-1-11-27(36)12-2-22)33(24-6-15-29(38)16-7-24)25-8-17-30(39)18-9-25/h1-2,4-18,20-21,36-38H
InChIKey DGNDPPRQBPGDSU-UHFFFAOYSA-N
Literature Reference Author C.YANG,Y.SHAO,K.LI,W.XIA
Literature Reference Citation BEIL.J.ORG.CHEM.,8,1884(2012)
Literature Reference DOI 10.3762/bjoc.8.217
Molecular Weight 510.546 g/mol
Solvent ACETONE-D6
Source File Reference UWIR11101