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1-(3,4-DIHYDRO-3,5-DIHYDROXY-2-METHYL-2-(3-METHYL-2-BUTENYL)-2H-1-BENZOPYRAN-6-YL-3-(4-HYDROXYPHENYL)-(2E)-PROPEN-1-ONE
SpectraBase Compound ID 12bBcFEguTf
InChI InChI=1S/C25H28O5/c1-16(2)5-4-14-25(3)23(28)15-20-22(30-25)13-11-19(24(20)29)21(27)12-8-17-6-9-18(26)10-7-17/h5-13,23,26,28-29H,4,14-15H2,1-3H3/b12-8+
InChIKey SNJAWBNQVIXVSK-XYOKQWHBSA-N
Mol Weight 408.49 g/mol
Molecular Formula C25H28O5
Exact Mass 408.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DCvX67kL0tg
Name 1-(3,4-DIHYDRO-3,5-DIHYDROXY-2-METHYL-2-(3-METHYL-2-BUTENYL)-2H-1-BENZOPYRAN-6-YL-3-(4-HYDROXYPHENYL)-(2E)-PROPEN-1-ONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28O5
InChI InChI=1S/C25H28O5/c1-16(2)5-4-14-25(3)23(28)15-20-22(30-25)13-11-19(24(20)29)21(27)12-8-17-6-9-18(26)10-7-17/h5-13,23,26,28-29H,4,14-15H2,1-3H3/b12-8+
InChIKey SNJAWBNQVIXVSK-XYOKQWHBSA-N
Literature Reference Author L.JAYASINGHE,G.K.RUPASINGHE,N.HARA,Y.FUJIMOTO
Literature Reference Citation PHYTOCHEM.,67,1353(2006)
Literature Reference DOI 10.1016/j.phytochem.2006.04.011
Molecular Weight 408.494 g/mol
Sample ID 67027
Solvent CDCl3:CD3OD=10:1