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2-Amino-3-phosphono-propionic acid, 3TMS
SpectraBase Compound ID BKyKVFzeCeV
InChI InChI=1S/C12H32NO5PSi3/c1-20(2,3)16-12(14)11(13)10-19(15,17-21(4,5)6)18-22(7,8)9/h11H,10,13H2,1-9H3/t11-/m0/s1
InChIKey IEBYFOGJBVKBLH-NSHDSACASA-N
Mol Weight 385.6 g/mol
Molecular Formula C12H32NO5PSi3
Exact Mass 385.13259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B6HRTnFddKv
Name 2-Amino-3-phosphono-propionic acid, 3TMS
Alternate Name(s) l-ap3, 3TMS 3-Phosphono-D-alanine, 3TMS 3-Phosphono-L-alanine, 3TMS NCIStruc1_000248, 3TMS NCIStruc2_000002, 3TMS A154_SIGMA, 3TMS (2R)-2-amino-3-phosphonopropanoic acid, 3TMS Trimethylsilyl (R)-2-amino-3-(bis((trimethylsilyl)oxy)phosphoryl)propanoate
Comments Derivatization type: 3 TMS (mass: 385.133); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000030; Note: The molecular formula of the structure shown is C3H8NO5P - which differs from the formula reported for the mass spectrum (C12H32NO5PSi3)
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Formula C12H32NO5PSi3
InChI InChI=1S/C12H32NO5PSi3/c1-20(2,3)16-12(14)11(13)10-19(15,17-21(4,5)6)18-22(7,8)9/h11H,10,13H2,1-9H3/t11-/m0/s1
InChIKey IEBYFOGJBVKBLH-NSHDSACASA-N
Molecular Weight 385.619 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]
SPLASH splash10-014r-0981000000-493749ab158791c9f60f
Source of Spectrum FM-2019-30-0
Wiley ID 1817731