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3-(N-Pentyl)oxyflavone
SpectraBase Compound ID APZAWxK8Kcj
InChI InChI=1S/C20H20O3/c1-2-3-9-14-22-20-18(21)16-12-7-8-13-17(16)23-19(20)15-10-5-4-6-11-15/h4-8,10-13H,2-3,9,14H2,1H3
InChIKey KDRSVYHUPQKSIN-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 IIYzhQKRSyq
Name 3-(N-Pentyl)oxyflavone
Comments Computed using HOSE algorithm
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Exact Mass 308.141244501 u
Formula C20H20O3
InChI InChI=1S/C20H20O3/c1-2-3-9-14-22-20-18(21)16-12-7-8-13-17(16)23-19(20)15-10-5-4-6-11-15/h4-8,10-13H,2-3,9,14H2,1H3
InChIKey KDRSVYHUPQKSIN-UHFFFAOYSA-N
Molecular Weight 308.377 g/mol
SMILES C1=CC=CC=C1C1=C(OCCCCC)C(C2=C(C=CC=C2)O1)=O