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allothreonine, 2TMS
SpectraBase Compound ID 73YJPSF2Fwq
InChI InChI=1S/C10H25NO3Si2/c1-8(13-15(2,3)4)9(11)10(12)14-16(5,6)7/h8-9H,11H2,1-7H3/t8-,9-/m0/s1
InChIKey CKXHAGKHQXMUJP-IUCAKERBSA-N
Mol Weight 263.48 g/mol
Molecular Formula C10H25NO3Si2
Exact Mass 263.137297 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9eFCU5NWKct
Name allothreonine, 2TMS
Comments Derivatization type: 2 TMS (mass: 263.137); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000019; Note: The molecular formula of the structure shown is C4H9NO3 - which differs from the formula reported for the mass spectrum (C10H25NO3Si2)
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Formula C10H25NO3Si2
InChI InChI=1S/C10H25NO3Si2/c1-8(13-15(2,3)4)9(11)10(12)14-16(5,6)7/h8-9H,11H2,1-7H3/t8-,9-/m0/s1
InChIKey CKXHAGKHQXMUJP-IUCAKERBSA-N
Molecular Weight 263.484 g/mol
SMILES N[C@@]([C@](C)(O[Si](C)(C)C)[H])(C(=O)O[Si](C)(C)C)[H]
SPLASH splash10-0159-0900000000-35e52e63231156c1b52c
Source of Spectrum FM-2019-19-0
Synonyms L-allo-threonine, 2TMS L-Allothreonine, 2TMS allo-L-Threonine, 2TMS L-threonine, 2TMS nchembio856-comp3, 2TMS ALLO-THREONINE, 2TMS (2S,3S)-2-amino-3-hydroxybutanoic acid, 2TMS Trimethylsilyl O-(trimethylsilyl)-L-allothreoninate
Wiley ID 1817720