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Quercetin, tetra-TMS
SpectraBase Compound ID KI0N2rlzQM7
InChI InChI=1S/C27H42O7Si4/c1-35(2,3)31-19-16-20(28)24-23(17-19)30-26(27(25(24)29)34-38(10,11)12)18-13-14-21(32-36(4,5)6)22(15-18)33-37(7,8)9/h13-17,28H,1-12H3
InChIKey VLVPTPLWQZRZCD-UHFFFAOYSA-N
Mol Weight 591.0 g/mol
Molecular Formula C27H42O7Si4
Exact Mass 590.20076 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0ONGJ3JTO4
Name Quercetin, tetra-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 590.200759825 u
Formula C27H42O7Si4
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C27H42O7Si4/c1-35(2,3)31-19-16-20(28)24-23(17-19)30-26(27(25(24)29)34-38(10,11)12)18-13-14-21(32-36(4,5)6)22(15-18)33-37(7,8)9/h13-17,28H,1-12H3
InChIKey VLVPTPLWQZRZCD-UHFFFAOYSA-N
Molecular Weight 590.966 g/mol
Nominal Mass 590 u
Number of Peaks 489
SMILES Oc1c2c(cc(c1)O[Si](C)(C)C)OC(=C(O[Si](C)(C)C)C2=O)c1ccc(O[Si](C)(C)C)c(O[Si](C)(C)C)c1
SPLASH splash10-05fr-5123490000-a6646714a4bfc9071683
Source non-completely silanised quercetine
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Wiley ID VI000488