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Phenylalanine, mono-O-TMS
SpectraBase Compound ID 1JsDzIBah2v
InChI InChI=1S/C12H19NO2Si/c1-16(2,3)15-12(14)11(13)9-10-7-5-4-6-8-10/h4-8,11H,9,13H2,1-3H3
InChIKey NBXFAHHUVWSAFQ-UHFFFAOYSA-N
Mol Weight 237.37 g/mol
Molecular Formula C12H19NO2Si
Exact Mass 237.118505 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G8Wb1B2K1kP
Name phenylalanine, 1TMS
Comments Derivatization type: 1 TMS (mass: 237.119); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000426; Note: The molecular formula of the structure shown is C9H11NO2 - which differs from the formula reported for the mass spectrum (C12H19NO2Si)
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Formula C12H19NO2Si
InChI InChI=1S/C12H19NO2Si/c1-16(2,3)15-12(14)11(13)9-10-7-5-4-6-8-10/h4-8,11H,9,13H2,1-3H3
InChIKey NBXFAHHUVWSAFQ-UHFFFAOYSA-N
Molecular Weight 237.374 g/mol
SMILES NC(Cc1ccccc1)C(=O)O[Si](C)(C)C
SPLASH splash10-00di-2900000000-648734edf04acddfaada
Source of Spectrum FM-2019-426-0
Synonyms L-phenylalanine, 1TMS D-phenylalanine, 1TMS endophenyl, 1TMS Phenylalamine, 1TMS Sabiden, 1TMS 2-Amino-3-phenylpropanoic acid, 1TMS Trimethylsilyl phenylalaninate
Wiley ID 1818113