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Phenylethyl 4-acetoxy-(E)-caffeate, mono-TMS
SpectraBase Compound ID CVAj5izpokP
InChI InChI=1S/C22H26O5Si/c1-17(23)26-20-12-10-19(16-21(20)27-28(2,3)4)11-13-22(24)25-15-14-18-8-6-5-7-9-18/h5-13,16H,14-15H2,1-4H3/b13-11+
InChIKey HVUYHWOOMSKJCN-ACCUITESSA-N
Mol Weight 398.53 g/mol
Molecular Formula C22H26O5Si
Exact Mass 398.15495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gn0uHps8aZJ
Name Phenylethyl 4-acetoxy-(E)-caffeate, mono-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 398.154950467 u
Formula C22H26O5Si
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C22H26O5Si/c1-17(23)26-20-12-10-19(16-21(20)27-28(2,3)4)11-13-22(24)25-15-14-18-8-6-5-7-9-18/h5-13,16H,14-15H2,1-4H3/b13-11+
InChIKey HVUYHWOOMSKJCN-ACCUITESSA-N
Molecular Weight 398.530 g/mol
Nominal Mass 398 u
Number of Peaks 86
SMILES c1ccccc1CCOC(\C=C\c1cc(c(cc1)OC(C)=O)O[Si](C)(C)C)=O
SPLASH splash10-052r-3594000000-e8dc5ee287fa37648af9
Source poplar (P. nigra) buds; poplar type propolis
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Synonyms 2-Phenylethyl-4-acetyloxy-(E)-caffeate, mono-TMS
Wiley ID VI002076