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Eicosyl ferulate, mono-TMS (impure)
SpectraBase Compound ID 8RsLNJKA8GC
InChI InChI=1S/C33H58O4Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-28-36-33(34)27-25-30-24-26-31(32(29-30)35-2)37-38(3,4)5/h24-27,29H,6-23,28H2,1-5H3/b27-25+
InChIKey ULASBNYDRRGEDU-IMVLJIQESA-N
Mol Weight 546.9 g/mol
Molecular Formula C33H58O4Si
Exact Mass 546.410437 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JleB3dM0u88
Name Eicosyl ferulate, mono-TMS (impure)
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 546.410436879 u
Formula C33H58O4Si
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C33H58O4Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-28-36-33(34)27-25-30-24-26-31(32(29-30)35-2)37-38(3,4)5/h24-27,29H,6-23,28H2,1-5H3/b27-25+
InChIKey ULASBNYDRRGEDU-IMVLJIQESA-N
Molecular Weight 546.908 g/mol
Nominal Mass 546 u
Number of Peaks 61
SMILES C(CCCCCCCCCCCC)CCCCCCCOC(\C=C\c1cc(OC)c(cc1)O[Si](C)(C)C)=O
SPLASH splash10-0002-7580090000-070d0ffb0a4e9ff60bca
Source spruce (A. excelsa) bark
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Synonyms 1-Eicosyl ferulate, mono-TMS
Wiley ID VI000919