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7-[2-(Benzyloxy)benzyloxy]-5-hydroxyflavanone
SpectraBase Compound ID FlGjGDVeiXt
InChI InChI=1S/C29H24O5/c30-24-15-23(16-28-29(24)25(31)17-27(34-28)21-11-5-2-6-12-21)32-19-22-13-7-8-14-26(22)33-18-20-9-3-1-4-10-20/h1-16,27,30H,17-19H2
InChIKey UFCKIPFVXBFKDZ-UHFFFAOYSA-N
Mol Weight 452.51 g/mol
Molecular Formula C29H24O5
Exact Mass 452.162374 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JwRBgSTtJ3q
Name 7-[2-(Benzyloxy)benzyloxy]-5-hydroxyflavanone
Comments Computed using HOSE algorithm
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Exact Mass 452.162373868 u
Formula C29H24O5
InChI InChI=1S/C29H24O5/c30-24-15-23(16-28-29(24)25(31)17-27(34-28)21-11-5-2-6-12-21)32-19-22-13-7-8-14-26(22)33-18-20-9-3-1-4-10-20/h1-16,27,30H,17-19H2
InChIKey UFCKIPFVXBFKDZ-UHFFFAOYSA-N
Molecular Weight 452.506 g/mol
SMILES C1=2C(CC(OC2C=C(C=C1O)OCC=1C(OCC=2C=CC=CC2)=CC=CC1)C=1C=CC=CC1)=O