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7-(3-Methylbutyl)oxyflavone
SpectraBase Compound ID IoVtBbYzKS9
InChI InChI=1S/C20H20O3/c1-14(2)10-11-22-16-8-9-17-18(21)13-19(23-20(17)12-16)15-6-4-3-5-7-15/h3-9,12-14H,10-11H2,1-2H3
InChIKey WXNIIIIQMVGRAH-UHFFFAOYSA-N
Mol Weight 308.38 g/mol
Molecular Formula C20H20O3
Exact Mass 308.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2zjduMtwSJh
Name 7-(3-Methylbutyl)oxyflavone
Comments Computed using HOSE algorithm
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Exact Mass 308.141244501 u
Formula C20H20O3
InChI InChI=1S/C20H20O3/c1-14(2)10-11-22-16-8-9-17-18(21)13-19(23-20(17)12-16)15-6-4-3-5-7-15/h3-9,12-14H,10-11H2,1-2H3
InChIKey WXNIIIIQMVGRAH-UHFFFAOYSA-N
Molecular Weight 308.377 g/mol
SMILES C1=CC=CC=C1C1=CC(C2=C(C=C(C=C2)OCCC(C)C)O1)=O