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4',7-dihydroxyflavanone, 2TMS
SpectraBase Compound ID E5oWBrqV8KW
InChI InChI=1S/C21H28O4Si2/c1-26(2,3)24-16-9-7-15(8-10-16)20-14-19(22)18-12-11-17(13-21(18)23-20)25-27(4,5)6/h7-13,20H,14H2,1-6H3
InChIKey RJZXAQBOFIGXPA-UHFFFAOYSA-N
Mol Weight 400.62 g/mol
Molecular Formula C21H28O4Si2
Exact Mass 400.152612 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CnNhmaVL6pT
Name 4',7-dihydroxyflavanone, 2TMS
Alternate Name(s) Liquiritigenin, 2TMS AIDS095895, 2TMS AIDS-095895, 2TMS MLS000697612, 2TMS SMR000470946, 2TMS 7-Hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one, 2TMS 7-Hydroxy-2-(4-hydroxyphenyl)chroman-4-one, 2TMS 7-((trimethylsilyl)oxy)-2-(4-((trimethylsilyl)oxy)phenyl)chroman-4-one
Comments Derivatization type: 2 TMS (mass: 400.153); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000899; Note: The molecular formula of the structure shown is C15H12O4 - which differs from the formula reported for the mass spectrum (C21H28O4Si2)
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Formula C21H28O4Si2
InChI InChI=1S/C21H28O4Si2/c1-26(2,3)24-16-9-7-15(8-10-16)20-14-19(22)18-12-11-17(13-21(18)23-20)25-27(4,5)6/h7-13,20H,14H2,1-6H3
InChIKey RJZXAQBOFIGXPA-UHFFFAOYSA-N
Molecular Weight 400.621 g/mol
SMILES c1cc(ccc1C1CC(c2ccc(cc2O1)O[Si](C)(C)C)=O)O[Si](C)(C)C
SPLASH splash10-004l-0910000000-e5d98bde9a50344801b0
Source of Spectrum FM-2019-899-0
Wiley ID 1818565