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Irilone, di-TMS
SpectraBase Compound ID 56AH8KSgB4C
InChI InChI=1S/C22H26O6Si2/c1-29(2,3)27-15-9-7-14(8-10-15)16-12-24-17-11-18-21(26-13-25-18)22(19(17)20(16)23)28-30(4,5)6/h7-12H,13H2,1-6H3
InChIKey MFLBTHJBZYYCPE-UHFFFAOYSA-N
Mol Weight 442.61 g/mol
Molecular Formula C22H26O6Si2
Exact Mass 442.126792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I7nowt55PUg
Name Irilone, 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 442.126791621 u
Formula C22H26O6Si2
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C22H26O6Si2/c1-29(2,3)27-15-9-7-14(8-10-15)16-12-24-17-11-18-21(26-13-25-18)22(19(17)20(16)23)28-30(4,5)6/h7-12H,13H2,1-6H3
InChIKey MFLBTHJBZYYCPE-UHFFFAOYSA-N
Molecular Weight 442.614 g/mol
Nominal Mass 442 u
Number of Peaks 70
SMILES c12OCOc2c(c2C(C(=COc2c1)c1ccc(cc1)O[Si](C)(C)C)=O)O[Si](C)(C)C
SPLASH splash10-004i-2110900000-b3903c62adb773a8d4ec
Source Trifolium pratense roots
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Wiley ID VI000482