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phenaceturic aciid, 1TMS
SpectraBase Compound ID 1VeYCiYywcG
InChI InChI=1S/C13H19NO3Si/c1-18(2,3)17-13(16)10-14-12(15)9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3,(H,14,15)
InChIKey NUCQPVCNCWCHMW-UHFFFAOYSA-N
Mol Weight 265.38 g/mol
Molecular Formula C13H19NO3Si
Exact Mass 265.11342 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3GMmIcYT3jE
Name phenaceturic aciid, 1TMS
Comments Derivatization type: 1 TMS (mass: 265.113); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000835; Note: The molecular formula of the structure shown is C10H11NO3 - which differs from the formula reported for the mass spectrum (C13H19NO3Si)
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Formula C13H19NO3Si
InChI InChI=1S/C13H19NO3Si/c1-18(2,3)17-13(16)10-14-12(15)9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3,(H,14,15)
InChIKey NUCQPVCNCWCHMW-UHFFFAOYSA-N
Molecular Weight 265.384 g/mol
SMILES N(CC(=O)O[Si](C)(C)C)C(Cc1ccccc1)=O
SPLASH splash10-0006-9610000000-a0a62ed2be6c54c3a57e
Source of Spectrum FM-2019-835-0
Synonyms Phenaceturic acid, 1TMS Phenylacetylglycine, 1TMS Phenacetylglycine, 1TMS N-Phenacetylglycine, 1TMS N-Phenylacetylglycine, 1TMS N-(Phenylacetyl)glycine, 1TMS 2-[(2-phenylacetyl)amino]acetic acid, 1TMS Trimethylsilyl (2-phenylacetyl)glycinate
Wiley ID 1818509