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Hesperitin, 3TMS
SpectraBase Compound ID 7IHmxMHRJgP
InChI InChI=1S/C25H38O6Si3/c1-27-20-12-11-17(13-22(20)30-33(5,6)7)21-16-19(26)25-23(28-21)14-18(29-32(2,3)4)15-24(25)31-34(8,9)10/h11-15,21H,16H2,1-10H3
InChIKey IZQJRHUPCALGSH-UHFFFAOYSA-N
Mol Weight 518.8 g/mol
Molecular Formula C25H38O6Si3
Exact Mass 518.197619 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4699fZncI2n
Name Hesperitin, 3TMS
Comments Derivatization type: 3 TMS (mass: 518.198); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000476; Note: The molecular formula of the structure shown is C16H14O6 - which differs from the formula reported for the mass spectrum (C25H38O6Si3)
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Formula C25H38O6Si3
InChI InChI=1S/C25H38O6Si3/c1-27-20-12-11-17(13-22(20)30-33(5,6)7)21-16-19(26)25-23(28-21)14-18(29-32(2,3)4)15-24(25)31-34(8,9)10/h11-15,21H,16H2,1-10H3
InChIKey IZQJRHUPCALGSH-UHFFFAOYSA-N
Molecular Weight 518.828 g/mol
SMILES COc1ccc(cc1O[Si](C)(C)C)C1CC(c2c(cc(cc2O1)O[Si](C)(C)C)O[Si](C)(C)C)=O
SPLASH splash10-052f-1971000000-56754303127301d1b2ea
Source of Spectrum FM-2019-476-0
Synonyms Hesperetin, 3TMS Hesperitin, 3TMS NSC641520, 3TMS AIDS160644, 3TMS Cyanidanon 4'-methyl ether 1626, 3TMS AIDS-160644, 3TMS 5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)chroman-4-one, 3TMS 2-(4-Methoxy-3-((trimethylsilyl)oxy)phenyl)-5,7-bis((trimethylsilyl)oxy)chroman-4-one
Wiley ID 1818161