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[13C=O]-1-[2',4'-bis(Benzyloxy)-5'-benzyl-6'-hydroxyphenyl]ethanone
SpectraBase Compound ID GUytIoNFalj
InChI InChI=1S/C29H26O4/c1-21(30)28-27(33-20-24-15-9-4-10-16-24)18-26(32-19-23-13-7-3-8-14-23)25(29(28)31)17-22-11-5-2-6-12-22/h2-16,18,31H,17,19-20H2,1H3
InChIKey BKMQQNOVPSAVQL-UHFFFAOYSA-N
Mol Weight 438.52 g/mol
Molecular Formula C29H26O4
Exact Mass 438.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GGasBy7fXvK
Name [13C=O]-1-[2',4'-bis(Benzyloxy)-5'-benzyl-6'-hydroxyphenyl]ethanone
Comments Less than 3 mono-isotopic peaks
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Formula C29H26O4
InChI InChI=1S/C29H26O4/c1-21(30)28-27(33-20-24-15-9-4-10-16-24)18-26(32-19-23-13-7-3-8-14-23)25(29(28)31)17-22-11-5-2-6-12-22/h2-16,18,31H,17,19-20H2,1H3
InChIKey BKMQQNOVPSAVQL-UHFFFAOYSA-N
Molecular Weight 438.523 g/mol
SMILES Oc1c(c(cc(OCc2ccccc2)c1Cc1ccccc1)OCc1ccccc1)C(=O)C
SPLASH splash10-0006-9000000000-360bf83317eeca541d97
Source of Spectrum K1-2001-2382-7
Wiley ID 846472