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(E)-1-(2-HYDROXY-4-METHOXYMETHOXY-3-PRENYLPHENYL)-3-RUTHENOCENYL-2-PROPEN-1-ONE
SpectraBase Compound ID 3Pm4Ew1ZGPD
InChI InChI=1S/C21H19O4.C5H.Ru/c1-15(2)8-10-18-20(25-14-24-3)13-11-17(21(18)23)19(22)12-9-16-6-4-5-7-16;1-2-4-5-3-1;/h8-9,11-13,23H,10,14H2,1-3H3;1H;/b12-9+;;
InChIKey KSNAJFSRAAWNEV-ANOGCNOSSA-N
Mol Weight 497.51 g/mol
Molecular Formula C26H20O4Ru
Exact Mass 498.040499 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DsQFHuTdME4
Name (E)-1-(2-HYDROXY-4-METHOXYMETHOXY-3-PRENYLPHENYL)-3-RUTHENOCENYL-2-PROPEN-1-ONE
Compound Number 38
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H20O4Ru
InChI InChI=1S/C21H19O4.C5H.Ru/c1-15(2)8-10-18-20(25-14-24-3)13-11-17(21(18)23)19(22)12-9-16-6-4-5-7-16;1-2-4-5-3-1;/h8-9,11-13,23H,10,14H2,1-3H3;1H;/b12-9+;;
InChIKey KSNAJFSRAAWNEV-ANOGCNOSSA-N
Literature Reference Author J.P.GREALIS,H.MUELLER-BUNZ,Y.ORTIN,M.CASEY,M.J.MCGLINCHEY
Literature Reference Citation EUR.J.ORG.CHEM.,2013,332(2013)
Literature Reference DOI 10.1002/ejoc.201201063
Molecular Weight 497.512 g/mol
Solvent CDCl3
Source File Reference UWBT17376