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Benzeneacetic acid, 3-methoxy-4-[(trimethylsilyl)oxy]-, trimethylsilyl ester
SpectraBase Compound ID 5fezGhU0sNs
InChI InChI=1S/C15H26O4Si2/c1-17-14-10-12(11-15(16)19-21(5,6)7)8-9-13(14)18-20(2,3)4/h8-10H,11H2,1-7H3
InChIKey PPAQHWGGSXMRBE-UHFFFAOYSA-N
Mol Weight 326.54 g/mol
Molecular Formula C15H26O4Si2
Exact Mass 326.136962 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7E9iq6pOSRI
Name Homovanillic acid, 2TMS
Comments Derivatization type: 2 TMS (mass: 326.137); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000971; Note: The molecular formula of the structure shown is C9H10O4 - which differs from the formula reported for the mass spectrum (C15H26O4Si2)
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Formula C15H26O4Si2
InChI InChI=1S/C15H26O4Si2/c1-17-14-10-12(11-15(16)19-21(5,6)7)8-9-13(14)18-20(2,3)4/h8-10H,11H2,1-7H3
InChIKey PPAQHWGGSXMRBE-UHFFFAOYSA-N
Molecular Weight 326.539 g/mol
SMILES COc1cc(ccc1O[Si](C)(C)C)CC(=O)O[Si](C)(C)C
SPLASH splash10-056r-1961000000-fb318fdce51658d1bd48
Source of Spectrum FM-2019-971-0
Synonyms Homovanillic acid, 2TMS Homovanillate, 2TMS Vanillacetic acid, 2TMS HMPA, 2TMS Lopac-H-1252, 2TMS H1252_SIGMA, 2TMS 2-(4-hydroxy-3-methoxyphenyl)acetic acid, 2TMS Trimethylsilyl 2-(3-methoxy-4-((trimethylsilyl)oxy)phenyl)acetate
Wiley ID 1818631