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alanine-alanine, 3TMS
SpectraBase Compound ID 2aRPKVhOtHz
InChI InChI=1S/C15H36N2O3Si3/c1-12(16-21(3,4)5)14(18)17(22(6,7)8)13(2)15(19)20-23(9,10)11/h12-13,16H,1-11H3
InChIKey BKKLJNPVRWBWQI-UHFFFAOYSA-N
Mol Weight 376.7 g/mol
Molecular Formula C15H36N2O3Si3
Exact Mass 376.203373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BbQzlTAUOds
Name alanine-alanine, 3TMS
Comments Derivatization type: 3 TMS (mass: 376.203); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000661; Note: The molecular formula of the structure shown is C6H12N2O3 - which differs from the formula reported for the mass spectrum (C15H36N2O3Si3)
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Formula C15H36N2O3Si3
InChI InChI=1S/C15H36N2O3Si3/c1-12(16-21(3,4)5)14(18)17(22(6,7)8)13(2)15(19)20-23(9,10)11/h12-13,16H,1-11H3
InChIKey BKKLJNPVRWBWQI-UHFFFAOYSA-N
Molecular Weight 376.719 g/mol
SMILES N(C(C)C(N(C(C)C(=O)O[Si](C)(C)C)[Si](C)(C)C)=O)[Si](C)(C)C
SPLASH splash10-0f79-0900000000-c576184e76444f6c75af
Source of Spectrum FM-2019-661-0
Synonyms Alanylalanine, 3TMS Dialanine, 3TMS Ala-ala, 3TMS Di-L-Alanine, 3TMS D-alanyl-D-alanine, 3TMS dl-Alanyl-l-alanine, 3TMS 2-(2-aminopropanoylamino)propanoic acid, 3TMS Trimethylsilyl N-(trimethylsilyl)-N-((trimethylsilyl)alanyl)alaninate
Wiley ID 1818339