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(+/-)-4'-BENZOYLOXY-3',4'-DIHYDROSESELIN
SpectraBase Compound ID vxxF77Shmk
InChI InChI=1S/C21H18O5/c1-21(2)12-16(24-20(23)14-6-4-3-5-7-14)18-15(26-21)10-8-13-9-11-17(22)25-19(13)18/h3-11,16H,12H2,1-2H3
InChIKey BYZRNQLMNVMJKG-UHFFFAOYSA-N
Mol Weight 350.37 g/mol
Molecular Formula C21H18O5
Exact Mass 350.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LYp9xHMk3d6
Name (+/-)-4'-BENZOYLOXY-3',4'-DIHYDROSESELIN
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H18O5
InChI InChI=1S/C21H18O5/c1-21(2)12-16(24-20(23)14-6-4-3-5-7-14)18-15(26-21)10-8-13-9-11-17(22)25-19(13)18/h3-11,16H,12H2,1-2H3
InChIKey BYZRNQLMNVMJKG-UHFFFAOYSA-N
Literature Reference Author P.MAGIATIS,E.MELLIOU,A.L.SKALTSOUNIS,S.MITAKU,S.LEONCE,P.REN ARD,A.PIERRE,G.ATASS
Literature Reference Citation J.NAT.PROD.,61,982(1998)
Literature Reference DOI 10.1021/np9800295
Molecular Weight 350.371 g/mol
Solvent CDCl3
Source File Reference UWRK3430