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sinapyl alcohol, 2TMS
SpectraBase Compound ID LEv266WVAu6
InChI InChI=1S/C17H30O4Si2/c1-18-15-12-14(10-9-11-20-22(3,4)5)13-16(19-2)17(15)21-23(6,7)8/h9-10,12-13H,11H2,1-8H3/b10-9+
InChIKey GYQFNHIVJPYRJM-MDZDMXLPSA-N
Mol Weight 354.59 g/mol
Molecular Formula C17H30O4Si2
Exact Mass 354.168263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1MweLHzgVM6
Name sinapyl alcohol, 2TMS
Comments Derivatization type: 2 TMS (mass: 354.168); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000664; Note: The molecular formula of the structure shown is C11H14O4 - which differs from the formula reported for the mass spectrum (C17H30O4Si2)
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Formula C17H30O4Si2
InChI InChI=1S/C17H30O4Si2/c1-18-15-12-14(10-9-11-20-22(3,4)5)13-16(19-2)17(15)21-23(6,7)8/h9-10,12-13H,11H2,1-8H3/b10-9+
InChIKey GYQFNHIVJPYRJM-MDZDMXLPSA-N
Molecular Weight 354.593 g/mol
SMILES COc1cc(\C=C\CO[Si](C)(C)C)cc(c1O[Si](C)(C)C)OC
SPLASH splash10-0ff0-1962000000-27876c55e4a9a151b56d
Source of Spectrum FM-2019-664-0
Synonyms Sinapyl alcohol, 2TMS Sinapic alcohol, 2TMS Sinapoyl alcohol, 2TMS Sinapyl alcohol, (E), 2TMS 404586_ALDRICH, 2TMS CHEBI:28813, 2TMS 4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol, 2TMS (E)-((3-(3,5-dimethoxy-4-((trimethylsilyl)oxy)phenyl)allyl)oxy)trimethylsilane
Wiley ID 1818342