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(2,4-Dibenzoxy-6-methyl-phenyl)-(3,4,6-tribenzoxy-2-methyl-phenyl)methanone

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(2,4-Dibenzoxy-6-methyl-phenyl)-(3,4,6-tribenzoxy-2-methyl-phenyl)methanone
SpectraBase Compound ID IoFhgsXKWpG
InChI InChI=1S/C50H44O6/c1-36-28-43(52-31-38-18-8-3-9-19-38)29-44(53-32-39-20-10-4-11-21-39)47(36)49(51)48-37(2)50(56-35-42-26-16-7-17-27-42)46(55-34-41-24-14-6-15-25-41)30-45(48)54-33-40-22-12-5-13-23-40/h3-30H,31-35H2,1-2H3
InChIKey BCJMNWIWIZJNRO-UHFFFAOYSA-N
Mol Weight 740.9 g/mol
Molecular Formula C50H44O6
Exact Mass 740.313789 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JiQB1TAoN5D
Name (2,4-Dibenzoxy-6-methyl-phenyl)-(3,4,6-tribenzoxy-2-methyl-phenyl)methanone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 740.313789131 u
Formula C50H44O6
InChI InChI=1S/C50H44O6/c1-36-28-43(52-31-38-18-8-3-9-19-38)29-44(53-32-39-20-10-4-11-21-39)47(36)49(51)48-37(2)50(56-35-42-26-16-7-17-27-42)46(55-34-41-24-14-6-15-25-41)30-45(48)54-33-40-22-12-5-13-23-40/h3-30H,31-35H2,1-2H3
InChIKey BCJMNWIWIZJNRO-UHFFFAOYSA-N
Molecular Weight 740.896 g/mol
SMILES C1(C(C=2C(=CC(=CC2C)OCC2=CC=CC=C2)OCC=2C=CC=CC2)=O)=C(C(OCC2=CC=CC=C2)=C(C=C1OCC=1C=CC=CC1)OCC=1C=CC=CC1)C