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Genistin, hexa-TMS
SpectraBase Compound ID Dgm8dDavKg1
InChI InChI=1S/C39H68O10Si6/c1-50(2,3)42-26-33-36(47-53(10,11)12)37(48-54(13,14)15)38(49-55(16,17)18)39(44-33)43-29-23-31-34(32(24-29)46-52(7,8)9)35(40)30(25-41-31)27-19-21-28(22-20-27)45-51(4,5)6/h19-25,33,36-39H,26H2,1-18H3
InChIKey YAUVNZRHPIOBLX-UHFFFAOYSA-N
Mol Weight 865.5 g/mol
Molecular Formula C39H68O10Si6
Exact Mass 864.342808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K3g0vdjRrZH
Name Genistin, hexa-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 864.342807590 u
Formula C39H68O10Si6
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C39H68O10Si6/c1-50(2,3)42-26-33-36(47-53(10,11)12)37(48-54(13,14)15)38(49-55(16,17)18)39(44-33)43-29-23-31-34(32(24-29)46-52(7,8)9)35(40)30(25-41-31)27-19-21-28(22-20-27)45-51(4,5)6/h19-25,33,36-39H,26H2,1-18H3
InChIKey YAUVNZRHPIOBLX-UHFFFAOYSA-N
Molecular Weight 865.473 g/mol
Nominal Mass 864 u
Number of Peaks 410
SMILES C1(C(OC(C(C1O[Si](C)(C)C)O[Si](C)(C)C)CO[Si](C)(C)C)Oc1cc2OC=C(C(c2c(c1)O[Si](C)(C)C)=O)c1ccc(cc1)O[Si](C)(C)C)O[Si](C)(C)C
SPLASH splash10-022a-4449400000-b3f9c45c88ede9d51cb2
Source Sigma
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Synonyms Genistein 7-O-.beta.-D-glucopyranoside, hexa-TMS
Wiley ID VI000473