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Pyroglutamic acid 2TMS
SpectraBase Compound ID IkcsKZOyQDn
InChI InChI=1S/C11H23NO3Si2/c1-16(2,3)12-9(7-8-10(12)13)11(14)15-17(4,5)6/h9H,7-8H2,1-6H3/t9-/m0/s1
InChIKey QACGFKAUSXGLCU-VIFPVBQESA-N
Mol Weight 273.48 g/mol
Molecular Formula C11H23NO3Si2
Exact Mass 273.121647 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HuokVPfL8nI
Name Oxoproline, 2TMS
Comments Derivatization type: 2 TMS (mass: 273.122); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000387; Note: The molecular formula of the structure shown is C5H7NO3 - which differs from the formula reported for the mass spectrum (C11H23NO3Si2)
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Formula C11H23NO3Si2
InChI InChI=1S/C11H23NO3Si2/c1-16(2,3)12-9(7-8-10(12)13)11(14)15-17(4,5)6/h9H,7-8H2,1-6H3/t9-/m0/s1
InChIKey QACGFKAUSXGLCU-VIFPVBQESA-N
Molecular Weight 273.479 g/mol
SMILES C1CC(N([C@@]1(C(=O)O[Si](C)(C)C)[H])[Si](C)(C)C)=O
SPLASH splash10-0a4i-0900000000-7bfcebd8f6c37a892c04
Source of Spectrum FM-2019-387-0
Synonyms Pyroglutamic acid, 2TMS L-Pyroglutamic acid, 2TMS Pidolic acid, 2TMS 5-Oxo-L-proline, 2TMS Pyroglutamate, 2TMS Proline, 5-oxo-, 2TMS (2S)-5-oxopyrrolidine-2-carboxylic acid, 2TMS Trimethylsilyl (S)-5-oxo-1-(trimethylsilyl)pyrrolidine-2-carboxylate
Wiley ID 1818074