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Equol, di-TMS
SpectraBase Compound ID EEVH8KGCBgY
InChI InChI=1S/C21H30O3Si2/c1-25(2,3)23-19-10-7-16(8-11-19)18-13-17-9-12-20(24-26(4,5)6)14-21(17)22-15-18/h7-12,14,18H,13,15H2,1-6H3
InChIKey LLFRZHYRWGUGIZ-UHFFFAOYSA-N
Mol Weight 386.64 g/mol
Molecular Formula C21H30O3Si2
Exact Mass 386.173348 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EaULalrtqIf
Name Equol, di-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 386.173347893 u
Formula C21H30O3Si2
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C21H30O3Si2/c1-25(2,3)23-19-10-7-16(8-11-19)18-13-17-9-12-20(24-26(4,5)6)14-21(17)22-15-18/h7-12,14,18H,13,15H2,1-6H3
InChIKey LLFRZHYRWGUGIZ-UHFFFAOYSA-N
Molecular Weight 386.638 g/mol
Nominal Mass 386 u
Number of Peaks 189
SMILES c1c(ccc(c1)C1Cc2ccc(cc2OC1)O[Si](C)(C)C)O[Si](C)(C)C
SPLASH splash10-0006-2912000000-33f16a5d156de6ac5f1b
Source Sigma-Aldrich
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Synonyms 4',7-Isoflavandiol, di-TMS
Wiley ID VI001487