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1-(3-Methoxy-4-oxidanyl-phenyl)-8-(3-methoxy-4-phenylmethoxy-phenyl)octane-1,8-dione

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-(3-Methoxy-4-oxidanyl-phenyl)-8-(3-methoxy-4-phenylmethoxy-phenyl)octane-1,8-dione
SpectraBase Compound ID G8irxDhwAui
InChI InChI=1S/C29H32O6/c1-33-28-18-22(14-16-26(28)32)24(30)12-8-3-4-9-13-25(31)23-15-17-27(29(19-23)34-2)35-20-21-10-6-5-7-11-21/h5-7,10-11,14-19,32H,3-4,8-9,12-13,20H2,1-2H3
InChIKey DJGOGJAGQSZHKM-UHFFFAOYSA-N
Mol Weight 476.6 g/mol
Molecular Formula C29H32O6
Exact Mass 476.219889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GbfPtrmg2El
Name 1-(3-Methoxy-4-oxidanyl-phenyl)-8-(3-methoxy-4-phenylmethoxy-phenyl)octane-1,8-dione
Comments Computed using HOSE algorithm
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Exact Mass 476.219888744 u
Formula C29H32O6
InChI InChI=1S/C29H32O6/c1-33-28-18-22(14-16-26(28)32)24(30)12-8-3-4-9-13-25(31)23-15-17-27(29(19-23)34-2)35-20-21-10-6-5-7-11-21/h5-7,10-11,14-19,32H,3-4,8-9,12-13,20H2,1-2H3
InChIKey DJGOGJAGQSZHKM-UHFFFAOYSA-N
Molecular Weight 476.569 g/mol
SMILES C=1(C=C(OC)C(=CC1)OCC1=CC=CC=C1)C(=O)CCCCCCC(C=1C=C(OC)C(=CC1)O)=O