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vanillin, 1TMS, 1MEOX
SpectraBase Compound ID 9EsmFNrBjrS
InChI InChI=1S/C12H19NO3Si/c1-14-12-8-10(9-13-15-2)6-7-11(12)16-17(3,4)5/h6-9H,1-5H3/b13-9-
InChIKey QRZHLXDYKDCOPI-LCYFTJDESA-N
Mol Weight 253.37 g/mol
Molecular Formula C12H19NO3Si
Exact Mass 253.11342 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID mPT1KGeExv
Name vanillin, 1TMS, 1MEOX
Comments Derivatization type: 1 TMS (mass: 253.113); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000952; Note: The molecular formula of the structure shown is C8H8O3 - which differs from the formula reported for the mass spectrum (C12H19NO3Si)
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Formula C12H19NO3Si
InChI InChI=1S/C12H19NO3Si/c1-14-12-8-10(9-13-15-2)6-7-11(12)16-17(3,4)5/h6-9H,1-5H3/b13-9-
InChIKey QRZHLXDYKDCOPI-LCYFTJDESA-N
Molecular Weight 253.373 g/mol
SMILES COc1cc(ccc1O[Si](C)(C)C)\C=N/OC
SPLASH splash10-00dr-1950000000-fcf29b6da03ee4aa69af
Source of Spectrum FM-2019-952-0
Synonyms Vanillaldehyde, 1TMS, 1MEOX Vanillic aldehyde, 1TMS, 1MEOX Vanilla, 1TMS, 1MEOX Lioxin, 1TMS, 1MEOX Zimco, 1TMS, 1MEOX 4-Hydroxy-3-methoxybenzaldehyde, 1TMS, 1MEOX (Z)-3-methoxy-4-((trimethylsilyl)oxy)benzaldehyde O-methyl oxime
Wiley ID 1818613