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Daidzin, penta-TMS
SpectraBase Compound ID 43vmnh1D1ka
InChI InChI=1S/C36H60O9Si5/c1-46(2,3)39-24-31-33(43-48(7,8)9)34(44-49(10,11)12)35(45-50(13,14)15)36(41-31)40-27-20-21-28-30(22-27)38-23-29(32(28)37)25-16-18-26(19-17-25)42-47(4,5)6/h16-23,31,33-36H,24H2,1-15H3
InChIKey MMZLJRVORLCILY-UHFFFAOYSA-N
Mol Weight 777.3 g/mol
Molecular Formula C36H60O9Si5
Exact Mass 776.308366 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AQ8FzectL9M
Name Daidzin, penta-TMS
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 776.308366178 u
Formula C36H60O9Si5
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C36H60O9Si5/c1-46(2,3)39-24-31-33(43-48(7,8)9)34(44-49(10,11)12)35(45-50(13,14)15)36(41-31)40-27-20-21-28-30(22-27)38-23-29(32(28)37)25-16-18-26(19-17-25)42-47(4,5)6/h16-23,31,33-36H,24H2,1-15H3
InChIKey MMZLJRVORLCILY-UHFFFAOYSA-N
Molecular Weight 777.292 g/mol
Nominal Mass 776 u
Number of Peaks 210
SMILES C1(OC(C(C(C1O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)CO[Si](C)(C)C)Oc1ccc2C(C(c3ccc(cc3)O[Si](C)(C)C)=COc2c1)=O
SPLASH splash10-03di-2349000000-db80295a1a9f39600990
Source Cayman Chemical
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Synonyms Daidzein b.beta.glucopyranoside, penta-TMS
Wiley ID VI001470