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threo-beta hydroxyaspartate, 4TMS
SpectraBase Compound ID B609ae7LvjN
InChI InChI=1S/C16H39NO5Si4/c1-23(2,3)17-13(15(18)21-25(7,8)9)14(20-24(4,5)6)16(19)22-26(10,11)12/h13-14,17H,1-12H3
InChIKey CYYNDEURRKOTFM-UHFFFAOYSA-N
Mol Weight 437.8 g/mol
Molecular Formula C16H39NO5Si4
Exact Mass 437.190529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2rJdVeg3xQ
Name threo-beta hydroxyaspartate, 4TMS
Comments Derivatization type: 4 TMS (mass: 437.191); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000880; Note: The molecular formula of the structure shown is C4H7NO5 - which differs from the formula reported for the mass spectrum (C16H39NO5Si4)
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Formula C16H39NO5Si4
InChI InChI=1S/C16H39NO5Si4/c1-23(2,3)17-13(15(18)21-25(7,8)9)14(20-24(4,5)6)16(19)22-26(10,11)12/h13-14,17H,1-12H3
InChIKey CYYNDEURRKOTFM-UHFFFAOYSA-N
Molecular Weight 437.830 g/mol
SMILES N(C(C(C(=O)O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C
SPLASH splash10-014j-0971000000-c7b8fbc3b6a969c66937
Source of Spectrum FM-2019-880-0
Synonyms 3-Hydroxyaspartic acid, 4TMS Malic acid, 3-amino-, 4TMS Spectrum_001134, 4TMS beta-Hydroxyaspartic acid, 4TMS Spectrum2_001914, 4TMS Spectrum3_001123, 4TMS threo-beta-hydroxyaspartate, 4TMS 2-Amino-3-hydroxybutanedioic acid, 4TMS bis(trimethylsilyl) 2-((trimethylsilyl)amino)-3-((trimethylsilyl)oxy)succinate
Wiley ID 1818548