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2-Amino-3-phosphono-propionic acid, 4TMS
SpectraBase Compound ID COOUCQv1Vs8
InChI InChI=1S/C15H40NO5PSi4/c1-23(2,3)16-14(15(17)19-24(4,5)6)13-22(18,20-25(7,8)9)21-26(10,11)12/h14,16H,13H2,1-12H3/t14-/m0/s1
InChIKey NHEFETNJXAVLCU-AWEZNQCLSA-N
Mol Weight 457.8 g/mol
Molecular Formula C15H40NO5PSi4
Exact Mass 457.172117 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4rVwu9JAd3
Name 2-Amino-3-phosphono-propionic acid, 4TMS
Comments Derivatization type: 4 TMS (mass: 457.172); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000031; Note: The molecular formula of the structure shown is C3H8NO5P - which differs from the formula reported for the mass spectrum (C15H40NO5PSi4)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H40NO5PSi4
InChI InChI=1S/C15H40NO5PSi4/c1-23(2,3)16-14(15(17)19-24(4,5)6)13-22(18,20-25(7,8)9)21-26(10,11)12/h14,16H,13H2,1-12H3/t14-/m0/s1
InChIKey NHEFETNJXAVLCU-AWEZNQCLSA-N
Molecular Weight 457.801 g/mol
SMILES N([C@@](CP(O[Si](C)(C)C)(O[Si](C)(C)C)=O)(C(=O)O[Si](C)(C)C)[H])[Si](C)(C)C
SPLASH splash10-0006-0945100000-a2c29509ba4ea9d572df
Source of Spectrum FM-2019-31-0
Synonyms l-ap3, 4TMS 3-Phosphono-D-alanine, 4TMS 3-Phosphono-L-alanine, 4TMS NCIStruc1_000248, 4TMS NCIStruc2_000002, 4TMS A154_SIGMA, 4TMS (2R)-2-amino-3-phosphonopropanoic acid, 4TMS Trimethylsilyl (R)-3-(bis((trimethylsilyl)oxy)phosphoryl)-2-((trimethylsilyl)amino)propanoate
Wiley ID 1817732