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Asparagine 3TMS
SpectraBase Compound ID Lc0yQBkvwvs
InChI InChI=1S/C13H32N2O3Si3/c1-19(2,3)14-11(13(17)18-21(7,8)9)10-12(16)15-20(4,5)6/h11,14H,10H2,1-9H3,(H,15,16)
InChIKey XENSVLLMVLKHGJ-UHFFFAOYSA-N
Mol Weight 348.7 g/mol
Molecular Formula C13H32N2O3Si3
Exact Mass 348.172073 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KEvpgZMI8ut
Name asparagine, 3TMS
Comments Derivatization type: 3 TMS (mass: 348.172); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000968; Note: The molecular formula of the structure shown is C4H8N2O3 - which differs from the formula reported for the mass spectrum (C13H32N2O3Si3)
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Formula C13H32N2O3Si3
InChI InChI=1S/C13H32N2O3Si3/c1-19(2,3)14-11(13(17)18-21(7,8)9)10-12(16)15-20(4,5)6/h11,14H,10H2,1-9H3,(H,15,16)
InChIKey XENSVLLMVLKHGJ-UHFFFAOYSA-N
Molecular Weight 348.665 g/mol
SMILES N(C(CC(N[Si](C)(C)C)=O)C(=O)O[Si](C)(C)C)[Si](C)(C)C
SPLASH splash10-0uxr-1920000000-3af0890432a0363c1144
Source of Spectrum FM-2019-968-0
Synonyms L-asparagine, 3TMS agedoite, 3TMS altheine, 3TMS DL-Asparagine, 3TMS asparagine acid, 3TMS 2,4-Diamino-4-oxobutanoic acid, 3TMS Trimethylsilyl N2,N4-bis(trimethylsilyl)asparaginate
Wiley ID 1818628